4-[(2-aminoacetyl)amino]-N,N-dipropylbenzamide

C15H23N3O2 — CID 119282805

IUPAC4-[(2-aminoacetyl)amino]-N,N-dipropylbenzamide
SMILESCCCN(CCC)C(=O)c1ccc(NC(=O)CN)cc1
InChIInChI=1S/C15H23N3O2/c1-3-9-18(10-4-2)15(20)12-5-7-13(8-6-12)17-14(19)11-16/h5-8H,3-4,9-11,16H2,1-2H3,(H,17,19)
InChIKeyWSIPNLDHKPWWGL-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.85
Rot. Bonds7

About 4-[(2-aminoacetyl)amino]-N,N-dipropylbenzamide

4-[(2-aminoacetyl)amino]-N,N-dipropylbenzamide (PubChem CID 119282805) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is 4-[(2-aminoacetyl)amino]-N,N-dipropylbenzamide.

Molecular Properties

Compound Name4-[(2-aminoacetyl)amino]-N,N-dipropylbenzamide
PubChem CID119282805
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC Name4-[(2-aminoacetyl)amino]-N,N-dipropylbenzamide
SMILESCCCN(CCC)C(=O)c1ccc(NC(=O)CN)cc1
InChIInChI=1S/C15H23N3O2/c1-3-9-18(10-4-2)15(20)12-5-7-13(8-6-12)17-14(19)11-16/h5-8H,3-4,9-11,16H2,1-2H3,(H,17,19)
InChIKeyWSIPNLDHKPWWGL-UHFFFAOYSA-N
XLogP1.85
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(2-aminoacetyl)amino]-N,N-diethylbenzamide;hydrochloride
CID 119268389
4-[[2-(4-methylanilino)acetyl]amino]-N,N-dipropylbenzamide
CID 54813932
4-[[2-(4-iodoanilino)-2-oxoethyl]amino]-N,N-dipropylbenzamide
CID 54832241
4-[[2-(4-bromoanilino)acetyl]amino]-N,N-dipropylbenzamide
CID 54811247
methyl 4-[[2-[4-(dipropylcarbamoyl)anilino]-2-oxoethyl]amino]benzoate
CID 54816864
4-[[2-(2,6-dimethylanilino)acetyl]amino]-N,N-dipropylbenzamide
CID 54818198
4-[[2-oxo-2-(4-propoxyanilino)ethyl]amino]-N,N-dipropylbenzamide
CID 54832147
4-(cyclopropanecarbonylamino)-N,N-dipropylbenzamide
CID 17196138
4-[(4-ethoxybenzoyl)amino]-N,N-dipropylbenzamide
CID 17196180
methyl 4-[[4-(dipropylcarbamoyl)benzoyl]amino]benzoate
CID 109049092
N-[4-[(2-aminoacetyl)amino]phenyl]propanamide
CID 43708679
4-[[2-(4-hexoxyanilino)acetyl]amino]-N,N-dipropylbenzamide
CID 54820826

Frequently Asked Questions

What is the IUPAC name of 4-[(2-aminoacetyl)amino]-N,N-dipropylbenzamide?
The IUPAC name of 4-[(2-aminoacetyl)amino]-N,N-dipropylbenzamide (CID 119282805) is 4-[(2-aminoacetyl)amino]-N,N-dipropylbenzamide.
What is the SMILES notation for 4-[(2-aminoacetyl)amino]-N,N-dipropylbenzamide?
The canonical SMILES for 4-[(2-aminoacetyl)amino]-N,N-dipropylbenzamide is CCCN(CCC)C(=O)c1ccc(NC(=O)CN)cc1.
What is the InChIKey of 4-[(2-aminoacetyl)amino]-N,N-dipropylbenzamide?
The InChIKey is WSIPNLDHKPWWGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-3-9-18(10-4-2)15(20)12-5-7-13(8-6-12)17-14(19)11-16/h5-8H,3-4,9-11,16H2,1-2H3,(H,17,19).
What are the key properties of 4-[(2-aminoacetyl)amino]-N,N-dipropylbenzamide?
4-[(2-aminoacetyl)amino]-N,N-dipropylbenzamide has a molecular weight of 277.37 g/mol, XLogP of 1.85, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-aminoacetyl)amino]-N,N-dipropylbenzamide is sourced from PubChem (CID 119282805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).