3-[(3-aminocyclopentyl)amino]-N,N-dimethylbenzamide

C14H21N3O — CID 79461660

IUPAC3-[(3-aminocyclopentyl)amino]-N,N-dimethylbenzamide
SMILESCN(C)C(=O)c1cccc(NC2CCC(N)C2)c1
InChIInChI=1S/C14H21N3O/c1-17(2)14(18)10-4-3-5-12(8-10)16-13-7-6-11(15)9-13/h3-5,8,11,13,16H,6-7,9,15H2,1-2H3
InChIKeyQOWYANQOQZOEGA-UHFFFAOYSA-N
MW247.34 g/mol
LogP1.68
Rot. Bonds3

About 3-[(3-aminocyclopentyl)amino]-N,N-dimethylbenzamide

3-[(3-aminocyclopentyl)amino]-N,N-dimethylbenzamide (PubChem CID 79461660) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is 3-[(3-aminocyclopentyl)amino]-N,N-dimethylbenzamide.

Molecular Properties

Compound Name3-[(3-aminocyclopentyl)amino]-N,N-dimethylbenzamide
PubChem CID79461660
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC Name3-[(3-aminocyclopentyl)amino]-N,N-dimethylbenzamide
SMILESCN(C)C(=O)c1cccc(NC2CCC(N)C2)c1
InChIInChI=1S/C14H21N3O/c1-17(2)14(18)10-4-3-5-12(8-10)16-13-7-6-11(15)9-13/h3-5,8,11,13,16H,6-7,9,15H2,1-2H3
InChIKeyQOWYANQOQZOEGA-UHFFFAOYSA-N
XLogP1.68
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(4-aminocyclohexyl)amino]-N,N-dimethylbenzamide
CID 79731247
N,N-dimethyl-3-[(4-methylcyclohexyl)amino]benzamide
CID 43725406
3-(cyclohexylamino)-N,N-dimethylbenzamide
CID 43725453
5-[(3-aminocyclopentyl)amino]-2-chloro-N,N-dimethylbenzamide
CID 79461229
N-[3-[(3-aminocyclopentyl)amino]phenyl]cyclopropanecarboxamide
CID 79462712
2-[(3-aminocyclopentyl)amino]-N,N-dimethylbenzamide
CID 79462007
tert-butyl N-[3-[(3-aminocyclopentyl)amino]phenyl]carbamate
CID 107239958
trans-(1R,3R)-3-N-phenylcyclopentane-1,3-diamine
CID 178138504
3-[(2-ethylcyclopentyl)amino]-N,N-dimethylbenzamide
CID 115928650
N,N-dimethyl-3-(methylamino)benzamide;ethane
CID 91408702
3-(cyclopentanecarbonylamino)-N,N-dimethylbenzamide
CID 29331430
3-(cyclohexanecarbonylamino)-N,N-dimethylbenzamide
CID 17231797

Frequently Asked Questions

What is the IUPAC name of 3-[(3-aminocyclopentyl)amino]-N,N-dimethylbenzamide?
The IUPAC name of 3-[(3-aminocyclopentyl)amino]-N,N-dimethylbenzamide (CID 79461660) is 3-[(3-aminocyclopentyl)amino]-N,N-dimethylbenzamide.
What is the SMILES notation for 3-[(3-aminocyclopentyl)amino]-N,N-dimethylbenzamide?
The canonical SMILES for 3-[(3-aminocyclopentyl)amino]-N,N-dimethylbenzamide is CN(C)C(=O)c1cccc(NC2CCC(N)C2)c1.
What is the InChIKey of 3-[(3-aminocyclopentyl)amino]-N,N-dimethylbenzamide?
The InChIKey is QOWYANQOQZOEGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-17(2)14(18)10-4-3-5-12(8-10)16-13-7-6-11(15)9-13/h3-5,8,11,13,16H,6-7,9,15H2,1-2H3.
What are the key properties of 3-[(3-aminocyclopentyl)amino]-N,N-dimethylbenzamide?
3-[(3-aminocyclopentyl)amino]-N,N-dimethylbenzamide has a molecular weight of 247.34 g/mol, XLogP of 1.68, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-aminocyclopentyl)amino]-N,N-dimethylbenzamide is sourced from PubChem (CID 79461660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).