N-[2-(4-aminobutylamino)ethyl]acetamide;N-[3-[4-(2-aminoethylamino)butylamino]propyl]acetamide;N-[2-(2-aminoethylamino)ethyl]acetamide;N-[3-(2-aminoethylamino)propyl]acetamide;N-[3-[4-[3-(2-aminoethylamino)propylamino]butylamino]propyl]acetamide;N-[2-[3-(2-aminoethylamino)propylamino]ethyl]acetamide;N-[3-[3-(2-aminoethylamino)propylamino]propyl]acetamide;N-[2-(3-aminopropylamino)ethyl]acetamide;N-[2-[2-(3-aminopropylamino)ethylamino]ethyl]acetamide

C81H195N33O9 — CID 159062074

IUPACN-[2-(4-aminobutylamino)ethyl]acetamide;N-[3-[4-(2-aminoethylamino)butylamino]propyl]acetamide;N-[2-(2-aminoethylamino)ethyl]acetamide;N-[3-(2-aminoethylamino)propyl]acetamide;N-[3-[4-[3-(2-aminoethylamino)propylamino]butylamino]propyl]acetamide;N-[2-[3-(2-aminoethylamino)propylamino]ethyl]acetamide;N-[3-[3-(2-aminoethylamino)propylamino]propyl]acetamide;N-[2-(3-aminopropylamino)ethyl]acetamide;N-[2-[2-(3-aminopropylamino)ethylamino]ethyl]acetamide
SMILESCC(=O)NCCCNCCCCNCCCNCCN.CC(=O)NCCCNCCCCNCCN.CC(=O)NCCCNCCCNCCN.CC(=O)NCCCNCCN.CC(=O)NCCNCCCCN.CC(=O)NCCNCCCN.CC(=O)NCCNCCCNCCN.CC(=O)NCCNCCN.CC(=O)NCCNCCNCCCN
InChIInChI=1S/C14H33N5O.C11H26N4O.C10H24N4O.2C9H22N4O.C8H19N3O.2C7H17N3O.C6H15N3O/c1-14(20)19-12-5-11-17-8-3-2-7-16-9-4-10-18-13-6-15;1-11(16)15-9-4-8-13-6-2-3-7-14-10-5-12;1-10(15)14-8-3-7-12-5-2-6-13-9-4-11;1-9(14)13-8-7-12-5-2-4-11-6-3-10;1-9(14)13-8-7-12-6-5-11-4-2-3-10;1-8(12)11-7-6-10-5-3-2-4-9;1-7(11)10-5-2-4-9-6-3-8;1-7(11)10-6-5-9-4-2-3-8;1-6(10)9-5-4-8-3-2-7/h16-18H,2-13,15H2,1H3,(H,19,20);13-14H,2-10,12H2,1H3,(H,15,16);12-13H,2-9,11H2,1H3,(H,14,15);2*11-12H,2-8,10H2,1H3,(H,13,14);10H,2-7,9H2,1H3,(H,11,12);2*9H,2-6,8H2,1H3,(H,10,11);8H,2-5,7H2,1H3,(H,9,10)
InChIKeyJYPFFHLEKZEMSD-UHFFFAOYSA-N
MW1775.67 g/mol
LogP-8.57
Rot. Bonds78

About N-[2-(4-aminobutylamino)ethyl]acetamide;N-[3-[4-(2-aminoethylamino)butylamino]propyl]acetamide;N-[2-(2-aminoethylamino)ethyl]acetamide;N-[3-(2-aminoethylamino)propyl]acetamide;N-[3-[4-[3-(2-aminoethylamino)propylamino]butylamino]propyl]acetamide;N-[2-[3-(2-aminoethylamino)propylamino]ethyl]acetamide;N-[3-[3-(2-aminoethylamino)propylamino]propyl]acetamide;N-[2-(3-aminopropylamino)ethyl]acetamide;N-[2-[2-(3-aminopropylamino)ethylamino]ethyl]acetamide

N-[2-(4-aminobutylamino)ethyl]acetamide;N-[3-[4-(2-aminoethylamino)butylamino]propyl]acetamide;N-[2-(2-aminoethylamino)ethyl]acetamide;N-[3-(2-aminoethylamino)propyl]acetamide;N-[3-[4-[3-(2-aminoethylamino)propylamino]butylamino]propyl]acetamide;N-[2-[3-(2-aminoethylamino)propylamino]ethyl]acetamide;N-[3-[3-(2-aminoethylamino)propylamino]propyl]acetamide;N-[2-(3-aminopropylamino)ethyl]acetamide;N-[2-[2-(3-aminopropylamino)ethylamino]ethyl]acetamide (PubChem CID 159062074) has the molecular formula C81H195N33O9 and a molecular weight of 1775.67 g/mol. Its IUPAC name is N-[2-(4-aminobutylamino)ethyl]acetamide;N-[3-[4-(2-aminoethylamino)butylamino]propyl]acetamide;N-[2-(2-aminoethylamino)ethyl]acetamide;N-[3-(2-aminoethylamino)propyl]acetamide;N-[3-[4-[3-(2-aminoethylamino)propylamino]butylamino]propyl]acetamide;N-[2-[3-(2-aminoethylamino)propylamino]ethyl]acetamide;N-[3-[3-(2-aminoethylamino)propylamino]propyl]acetamide;N-[2-(3-aminopropylamino)ethyl]acetamide;N-[2-[2-(3-aminopropylamino)ethylamino]ethyl]acetamide.

Molecular Properties

Compound NameN-[2-(4-aminobutylamino)ethyl]acetamide;N-[3-[4-(2-aminoethylamino)butylamino]propyl]acetamide;N-[2-(2-aminoethylamino)ethyl]acetamide;N-[3-(2-aminoethylamino)propyl]acetamide;N-[3-[4-[3-(2-aminoethylamino)propylamino]butylamino]propyl]acetamide;N-[2-[3-(2-aminoethylamino)propylamino]ethyl]acetamide;N-[3-[3-(2-aminoethylamino)propylamino]propyl]acetamide;N-[2-(3-aminopropylamino)ethyl]acetamide;N-[2-[2-(3-aminopropylamino)ethylamino]ethyl]acetamide
PubChem CID159062074
Molecular FormulaC81H195N33O9
Molecular Weight1775.67 g/mol
Exact Mass1774.58
IUPAC NameN-[2-(4-aminobutylamino)ethyl]acetamide;N-[3-[4-(2-aminoethylamino)butylamino]propyl]acetamide;N-[2-(2-aminoethylamino)ethyl]acetamide;N-[3-(2-aminoethylamino)propyl]acetamide;N-[3-[4-[3-(2-aminoethylamino)propylamino]butylamino]propyl]acetamide;N-[2-[3-(2-aminoethylamino)propylamino]ethyl]acetamide;N-[3-[3-(2-aminoethylamino)propylamino]propyl]acetamide;N-[2-(3-aminopropylamino)ethyl]acetamide;N-[2-[2-(3-aminopropylamino)ethylamino]ethyl]acetamide
SMILESCC(=O)NCCCNCCCCNCCCNCCN.CC(=O)NCCCNCCCCNCCN.CC(=O)NCCCNCCCNCCN.CC(=O)NCCCNCCN.CC(=O)NCCNCCCCN.CC(=O)NCCNCCCN.CC(=O)NCCNCCCNCCN.CC(=O)NCCNCCN.CC(=O)NCCNCCNCCCN
InChIInChI=1S/C14H33N5O.C11H26N4O.C10H24N4O.2C9H22N4O.C8H19N3O.2C7H17N3O.C6H15N3O/c1-14(20)19-12-5-11-17-8-3-2-7-16-9-4-10-18-13-6-15;1-11(16)15-9-4-8-13-6-2-3-7-14-10-5-12;1-10(15)14-8-3-7-12-5-2-6-13-9-4-11;1-9(14)13-8-7-12-5-2-4-11-6-3-10;1-9(14)13-8-7-12-6-5-11-4-2-3-10;1-8(12)11-7-6-10-5-3-2-4-9;1-7(11)10-5-2-4-9-6-3-8;1-7(11)10-6-5-9-4-2-3-8;1-6(10)9-5-4-8-3-2-7/h16-18H,2-13,15H2,1H3,(H,19,20);13-14H,2-10,12H2,1H3,(H,15,16);12-13H,2-9,11H2,1H3,(H,14,15);2*11-12H,2-8,10H2,1H3,(H,13,14);10H,2-7,9H2,1H3,(H,11,12);2*9H,2-6,8H2,1H3,(H,10,11);8H,2-5,7H2,1H3,(H,9,10)
InChIKeyJYPFFHLEKZEMSD-UHFFFAOYSA-N
XLogP-8.57
TPSA676.53 Ų
H-Bond Donors33
H-Bond Acceptors33
Rotatable Bonds78
Heavy Atoms123
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001775.67
LogP ≤ 5-8.57
H-Bond Donors ≤ 533
H-Bond Acceptors ≤ 1033

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[2-(4-aminobutylamino)ethyl]acetamide;N-[3-[4-(2-aminoethylamino)butylamino]propyl]acetamide;N-[2-(2-aminoethylamino)ethyl]acetamide;N-[3-(2-aminoethylamino)propyl]acetamide;N-[3-[4-[3-(2-aminoethylamino)propylamino]butylamino]propyl]acetamide;N-[2-[3-(2-aminoethylamino)propylamino]ethyl]acetamide;N-[3-[3-(2-aminoethylamino)propylamino]propyl]acetamide;N-[2-(3-aminopropylamino)ethyl]acetamide;N-[2-[2-(3-aminopropylamino)ethylamino]ethyl]acetamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[2-(4-aminobutylamino)ethyl]acetamide;N-[3-[4-(2-aminoethylamino)butylamino]propyl]acetamide;N-[2-(2-aminoethylamino)ethyl]acetamide;N-[3-(2-aminoethylamino)propyl]acetamide;N-[3-[4-[3-(2-aminoethylamino)propylamino]butylamino]propyl]acetamide;N-[2-[3-(2-aminoethylamino)propylamino]ethyl]acetamide;N-[3-[3-(2-aminoethylamino)propylamino]propyl]acetamide;N-[2-(3-aminopropylamino)ethyl]acetamide;N-[2-[2-(3-aminopropylamino)ethylamino]ethyl]acetamide?
The IUPAC name of N-[2-(4-aminobutylamino)ethyl]acetamide;N-[3-[4-(2-aminoethylamino)butylamino]propyl]acetamide;N-[2-(2-aminoethylamino)ethyl]acetamide;N-[3-(2-aminoethylamino)propyl]acetamide;N-[3-[4-[3-(2-aminoethylamino)propylamino]butylamino]propyl]acetamide;N-[2-[3-(2-aminoethylamino)propylamino]ethyl]acetamide;N-[3-[3-(2-aminoethylamino)propylamino]propyl]acetamide;N-[2-(3-aminopropylamino)ethyl]acetamide;N-[2-[2-(3-aminopropylamino)ethylamino]ethyl]acetamide (CID 159062074) is N-[2-(4-aminobutylamino)ethyl]acetamide;N-[3-[4-(2-aminoethylamino)butylamino]propyl]acetamide;N-[2-(2-aminoethylamino)ethyl]acetamide;N-[3-(2-aminoethylamino)propyl]acetamide;N-[3-[4-[3-(2-aminoethylamino)propylamino]butylamino]propyl]acetamide;N-[2-[3-(2-aminoethylamino)propylamino]ethyl]acetamide;N-[3-[3-(2-aminoethylamino)propylamino]propyl]acetamide;N-[2-(3-aminopropylamino)ethyl]acetamide;N-[2-[2-(3-aminopropylamino)ethylamino]ethyl]acetamide.
What is the SMILES notation for N-[2-(4-aminobutylamino)ethyl]acetamide;N-[3-[4-(2-aminoethylamino)butylamino]propyl]acetamide;N-[2-(2-aminoethylamino)ethyl]acetamide;N-[3-(2-aminoethylamino)propyl]acetamide;N-[3-[4-[3-(2-aminoethylamino)propylamino]butylamino]propyl]acetamide;N-[2-[3-(2-aminoethylamino)propylamino]ethyl]acetamide;N-[3-[3-(2-aminoethylamino)propylamino]propyl]acetamide;N-[2-(3-aminopropylamino)ethyl]acetamide;N-[2-[2-(3-aminopropylamino)ethylamino]ethyl]acetamide?
The canonical SMILES for N-[2-(4-aminobutylamino)ethyl]acetamide;N-[3-[4-(2-aminoethylamino)butylamino]propyl]acetamide;N-[2-(2-aminoethylamino)ethyl]acetamide;N-[3-(2-aminoethylamino)propyl]acetamide;N-[3-[4-[3-(2-aminoethylamino)propylamino]butylamino]propyl]acetamide;N-[2-[3-(2-aminoethylamino)propylamino]ethyl]acetamide;N-[3-[3-(2-aminoethylamino)propylamino]propyl]acetamide;N-[2-(3-aminopropylamino)ethyl]acetamide;N-[2-[2-(3-aminopropylamino)ethylamino]ethyl]acetamide is CC(=O)NCCCNCCCCNCCCNCCN.CC(=O)NCCCNCCCCNCCN.CC(=O)NCCCNCCCNCCN.CC(=O)NCCCNCCN.CC(=O)NCCNCCCCN.CC(=O)NCCNCCCN.CC(=O)NCCNCCCNCCN.CC(=O)NCCNCCN.CC(=O)NCCNCCNCCCN.
What is the InChIKey of N-[2-(4-aminobutylamino)ethyl]acetamide;N-[3-[4-(2-aminoethylamino)butylamino]propyl]acetamide;N-[2-(2-aminoethylamino)ethyl]acetamide;N-[3-(2-aminoethylamino)propyl]acetamide;N-[3-[4-[3-(2-aminoethylamino)propylamino]butylamino]propyl]acetamide;N-[2-[3-(2-aminoethylamino)propylamino]ethyl]acetamide;N-[3-[3-(2-aminoethylamino)propylamino]propyl]acetamide;N-[2-(3-aminopropylamino)ethyl]acetamide;N-[2-[2-(3-aminopropylamino)ethylamino]ethyl]acetamide?
The InChIKey is JYPFFHLEKZEMSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H33N5O.C11H26N4O.C10H24N4O.2C9H22N4O.C8H19N3O.2C7H17N3O.C6H15N3O/c1-14(20)19-12-5-11-17-8-3-2-7-16-9-4-10-18-13-6-15;1-11(16)15-9-4-8-13-6-2-3-7-14-10-5-12;1-10(15)14-8-3-7-12-5-2-6-13-9-4-11;1-9(14)13-8-7-12-5-2-4-11-6-3-10;1-9(14)13-8-7-12-6-5-11-4-2-3-10;1-8(12)11-7-6-10-5-3-2-4-9;1-7(11)10-5-2-4-9-6-3-8;1-7(11)10-6-5-9-4-2-3-8;1-6(10)9-5-4-8-3-2-7/h16-18H,2-13,15H2,1H3,(H,19,20);13-14H,2-10,12H2,1H3,(H,15,16);12-13H,2-9,11H2,1H3,(H,14,15);2*11-12H,2-8,10H2,1H3,(H,13,14);10H,2-7,9H2,1H3,(H,11,12);2*9H,2-6,8H2,1H3,(H,10,11);8H,2-5,7H2,1H3,(H,9,10).
What are the key properties of N-[2-(4-aminobutylamino)ethyl]acetamide;N-[3-[4-(2-aminoethylamino)butylamino]propyl]acetamide;N-[2-(2-aminoethylamino)ethyl]acetamide;N-[3-(2-aminoethylamino)propyl]acetamide;N-[3-[4-[3-(2-aminoethylamino)propylamino]butylamino]propyl]acetamide;N-[2-[3-(2-aminoethylamino)propylamino]ethyl]acetamide;N-[3-[3-(2-aminoethylamino)propylamino]propyl]acetamide;N-[2-(3-aminopropylamino)ethyl]acetamide;N-[2-[2-(3-aminopropylamino)ethylamino]ethyl]acetamide?
N-[2-(4-aminobutylamino)ethyl]acetamide;N-[3-[4-(2-aminoethylamino)butylamino]propyl]acetamide;N-[2-(2-aminoethylamino)ethyl]acetamide;N-[3-(2-aminoethylamino)propyl]acetamide;N-[3-[4-[3-(2-aminoethylamino)propylamino]butylamino]propyl]acetamide;N-[2-[3-(2-aminoethylamino)propylamino]ethyl]acetamide;N-[3-[3-(2-aminoethylamino)propylamino]propyl]acetamide;N-[2-(3-aminopropylamino)ethyl]acetamide;N-[2-[2-(3-aminopropylamino)ethylamino]ethyl]acetamide has a molecular weight of 1775.67 g/mol, XLogP of -8.57, 78 rotatable bonds, 33 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-aminobutylamino)ethyl]acetamide;N-[3-[4-(2-aminoethylamino)butylamino]propyl]acetamide;N-[2-(2-aminoethylamino)ethyl]acetamide;N-[3-(2-aminoethylamino)propyl]acetamide;N-[3-[4-[3-(2-aminoethylamino)propylamino]butylamino]propyl]acetamide;N-[2-[3-(2-aminoethylamino)propylamino]ethyl]acetamide;N-[3-[3-(2-aminoethylamino)propylamino]propyl]acetamide;N-[2-(3-aminopropylamino)ethyl]acetamide;N-[2-[2-(3-aminopropylamino)ethylamino]ethyl]acetamide is sourced from PubChem (CID 159062074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).