2-amino-N-[2-[3-[(2-methylpropan-2-yl)oxy]propylamino]-2-oxoethyl]acetamide

C11H23N3O3 — CID 147267401

IUPAC2-amino-N-[2-[3-[(2-methylpropan-2-yl)oxy]propylamino]-2-oxoethyl]acetamide
SMILESCC(C)(C)OCCCNC(=O)CNC(=O)CN
InChIInChI=1S/C11H23N3O3/c1-11(2,3)17-6-4-5-13-10(16)8-14-9(15)7-12/h4-8,12H2,1-3H3,(H,13,16)(H,14,15)
InChIKeyCPTMSPXHIWSERO-UHFFFAOYSA-N
MW245.32 g/mol
LogP-0.62
Rot. Bonds7

About 2-amino-N-[2-[3-[(2-methylpropan-2-yl)oxy]propylamino]-2-oxoethyl]acetamide

2-amino-N-[2-[3-[(2-methylpropan-2-yl)oxy]propylamino]-2-oxoethyl]acetamide (PubChem CID 147267401) has the molecular formula C11H23N3O3 and a molecular weight of 245.32 g/mol. Its IUPAC name is 2-amino-N-[2-[3-[(2-methylpropan-2-yl)oxy]propylamino]-2-oxoethyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[2-[3-[(2-methylpropan-2-yl)oxy]propylamino]-2-oxoethyl]acetamide
PubChem CID147267401
Molecular FormulaC11H23N3O3
Molecular Weight245.32 g/mol
Exact Mass245.17
IUPAC Name2-amino-N-[2-[3-[(2-methylpropan-2-yl)oxy]propylamino]-2-oxoethyl]acetamide
SMILESCC(C)(C)OCCCNC(=O)CNC(=O)CN
InChIInChI=1S/C11H23N3O3/c1-11(2,3)17-6-4-5-13-10(16)8-14-9(15)7-12/h4-8,12H2,1-3H3,(H,13,16)(H,14,15)
InChIKeyCPTMSPXHIWSERO-UHFFFAOYSA-N
XLogP-0.62
TPSA93.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 5-0.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-amino-N-[2-[3-(2-methoxyethoxy)propylamino]-2-oxoethyl]acetamide
CID 61274452
tert-butyl N-[3-[(2-aminoacetyl)amino]propyl]carbamate
CID 23591745
bromo 4-[[2-[(2-aminoacetyl)amino]acetyl]amino]-2,2-dimethylbutanoate
CID 175344037
2-amino-N-[2-[3-(cyclopropylmethoxy)propylamino]-2-oxoethyl]acetamide
CID 60847429
2-amino-N-[2-(2-ethoxyethylamino)-2-oxoethyl]acetamide
CID 60846761
2-amino-N-[2-oxo-2-(4,4,4-trifluorobutylamino)ethyl]acetamide
CID 115519305
2-amino-N-[3-[2-[2-(3-aminopropoxy)ethoxy]ethoxy]propyl]acetamide
CID 123586963
tert-butyl 2-[(2-aminoacetyl)amino]acetate
CID 15403805
2-amino-N-[2-[2-(2-hydroxyethoxy)ethylamino]-2-oxoethyl]acetamide
CID 61274286
acetic acid;2-amino-N-[10-[(2-aminoacetyl)amino]decyl]acetamide
CID 54606253
ethyl 2-[[2-[(2-aminoacetyl)amino]acetyl]amino]acetate
CID 7020070
6-[(2-methylpropan-2-yl)oxy]-N-(6-oxohexyl)hexanamide
CID 126707815

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-[3-[(2-methylpropan-2-yl)oxy]propylamino]-2-oxoethyl]acetamide?
The IUPAC name of 2-amino-N-[2-[3-[(2-methylpropan-2-yl)oxy]propylamino]-2-oxoethyl]acetamide (CID 147267401) is 2-amino-N-[2-[3-[(2-methylpropan-2-yl)oxy]propylamino]-2-oxoethyl]acetamide.
What is the SMILES notation for 2-amino-N-[2-[3-[(2-methylpropan-2-yl)oxy]propylamino]-2-oxoethyl]acetamide?
The canonical SMILES for 2-amino-N-[2-[3-[(2-methylpropan-2-yl)oxy]propylamino]-2-oxoethyl]acetamide is CC(C)(C)OCCCNC(=O)CNC(=O)CN.
What is the InChIKey of 2-amino-N-[2-[3-[(2-methylpropan-2-yl)oxy]propylamino]-2-oxoethyl]acetamide?
The InChIKey is CPTMSPXHIWSERO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O3/c1-11(2,3)17-6-4-5-13-10(16)8-14-9(15)7-12/h4-8,12H2,1-3H3,(H,13,16)(H,14,15).
What are the key properties of 2-amino-N-[2-[3-[(2-methylpropan-2-yl)oxy]propylamino]-2-oxoethyl]acetamide?
2-amino-N-[2-[3-[(2-methylpropan-2-yl)oxy]propylamino]-2-oxoethyl]acetamide has a molecular weight of 245.32 g/mol, XLogP of -0.62, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-[3-[(2-methylpropan-2-yl)oxy]propylamino]-2-oxoethyl]acetamide is sourced from PubChem (CID 147267401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).