5-amino-N-(2-aminoethyl)-2-[bis(2-aminoethyl)amino]pentanamide

C11H28N6O — CID 91323931

IUPAC5-amino-N-(2-aminoethyl)-2-[bis(2-aminoethyl)amino]pentanamide
SMILESNCCCC(C(=O)NCCN)N(CCN)CCN
InChIInChI=1S/C11H28N6O/c12-3-1-2-10(11(18)16-7-4-13)17(8-5-14)9-6-15/h10H,1-9,12-15H2,(H,16,18)
InChIKeyJVNABTCHYAUACN-UHFFFAOYSA-N
MW260.39 g/mol
LogP-2.61
Rot. Bonds11

About 5-amino-N-(2-aminoethyl)-2-[bis(2-aminoethyl)amino]pentanamide

5-amino-N-(2-aminoethyl)-2-[bis(2-aminoethyl)amino]pentanamide (PubChem CID 91323931) has the molecular formula C11H28N6O and a molecular weight of 260.39 g/mol. Its IUPAC name is 5-amino-N-(2-aminoethyl)-2-[bis(2-aminoethyl)amino]pentanamide.

Molecular Properties

Compound Name5-amino-N-(2-aminoethyl)-2-[bis(2-aminoethyl)amino]pentanamide
PubChem CID91323931
Molecular FormulaC11H28N6O
Molecular Weight260.39 g/mol
Exact Mass260.23
IUPAC Name5-amino-N-(2-aminoethyl)-2-[bis(2-aminoethyl)amino]pentanamide
SMILESNCCCC(C(=O)NCCN)N(CCN)CCN
InChIInChI=1S/C11H28N6O/c12-3-1-2-10(11(18)16-7-4-13)17(8-5-14)9-6-15/h10H,1-9,12-15H2,(H,16,18)
InChIKeyJVNABTCHYAUACN-UHFFFAOYSA-N
XLogP-2.61
TPSA136.42 Ų
H-Bond Donors5
H-Bond Acceptors6
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.39
LogP ≤ 5-2.61
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 106

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Related Compounds

4-amino-N-(3-aminopropyl)-2-methylbutanamide
CID 80543775
CID 158112465
CID 158112465
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CID 170685872
2-amino-N-(2-aminoethyl)propanamide;rutherfordium
CID 173496992
5-amino-2-methyl-N-pentylpentanamide
CID 104683456
5-amino-N-ethyl-2-methylpentanamide
CID 134525204
5-amino-2-methyl-N-(7-methyloctyl)pentanamide
CID 104684762
2-[2-aminoethyl(propyl)amino]-N-propylpropanamide
CID 61349368
(3S)-6-amino-3-(methylamino)hexan-2-one
CID 59098893
5-amino-2-hydroxy-N-methylsulfanylpentanamide
CID 91334836
(2S)-2-aminopropanoic acid;2-[bis(2-aminoethyl)amino]tetradecanoic acid
CID 87338408
5-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]-2-methylpentanamide
CID 113441005

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(2-aminoethyl)-2-[bis(2-aminoethyl)amino]pentanamide?
The IUPAC name of 5-amino-N-(2-aminoethyl)-2-[bis(2-aminoethyl)amino]pentanamide (CID 91323931) is 5-amino-N-(2-aminoethyl)-2-[bis(2-aminoethyl)amino]pentanamide.
What is the SMILES notation for 5-amino-N-(2-aminoethyl)-2-[bis(2-aminoethyl)amino]pentanamide?
The canonical SMILES for 5-amino-N-(2-aminoethyl)-2-[bis(2-aminoethyl)amino]pentanamide is NCCCC(C(=O)NCCN)N(CCN)CCN.
What is the InChIKey of 5-amino-N-(2-aminoethyl)-2-[bis(2-aminoethyl)amino]pentanamide?
The InChIKey is JVNABTCHYAUACN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H28N6O/c12-3-1-2-10(11(18)16-7-4-13)17(8-5-14)9-6-15/h10H,1-9,12-15H2,(H,16,18).
What are the key properties of 5-amino-N-(2-aminoethyl)-2-[bis(2-aminoethyl)amino]pentanamide?
5-amino-N-(2-aminoethyl)-2-[bis(2-aminoethyl)amino]pentanamide has a molecular weight of 260.39 g/mol, XLogP of -2.61, 11 rotatable bonds, 5 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(2-aminoethyl)-2-[bis(2-aminoethyl)amino]pentanamide is sourced from PubChem (CID 91323931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).