2-[(3-aminocyclopentyl)amino]-N,N-dimethylbenzamide

C14H21N3O — CID 79462007

IUPAC2-[(3-aminocyclopentyl)amino]-N,N-dimethylbenzamide
SMILESCN(C)C(=O)c1ccccc1NC1CCC(N)C1
InChIInChI=1S/C14H21N3O/c1-17(2)14(18)12-5-3-4-6-13(12)16-11-8-7-10(15)9-11/h3-6,10-11,16H,7-9,15H2,1-2H3
InChIKeyDRIRRJIMGTWSDA-UHFFFAOYSA-N
MW247.34 g/mol
LogP1.68
Rot. Bonds3

About 2-[(3-aminocyclopentyl)amino]-N,N-dimethylbenzamide

2-[(3-aminocyclopentyl)amino]-N,N-dimethylbenzamide (PubChem CID 79462007) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is 2-[(3-aminocyclopentyl)amino]-N,N-dimethylbenzamide.

Molecular Properties

Compound Name2-[(3-aminocyclopentyl)amino]-N,N-dimethylbenzamide
PubChem CID79462007
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC Name2-[(3-aminocyclopentyl)amino]-N,N-dimethylbenzamide
SMILESCN(C)C(=O)c1ccccc1NC1CCC(N)C1
InChIInChI=1S/C14H21N3O/c1-17(2)14(18)12-5-3-4-6-13(12)16-11-8-7-10(15)9-11/h3-6,10-11,16H,7-9,15H2,1-2H3
InChIKeyDRIRRJIMGTWSDA-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

N,N-dimethyl-2-(thian-4-ylamino)benzamide
CID 43738379
N,N-dimethyl-2-(pyrrolidin-3-ylamino)benzamide
CID 79731257
5-[(3-aminocyclopentyl)amino]-2-chloro-N,N-dimethylbenzamide
CID 79461229
3-[(3-aminocyclopentyl)amino]-N,N-dimethylbenzamide
CID 79461660
2-[(4-aminocyclohexyl)amino]-4-chloro-N,N-dimethylbenzamide
CID 79730315
2-[(4,4-dimethylcycloheptyl)amino]-N,N-dimethylbenzamide
CID 65083577
methyl 2-(cyclopropylamino)benzoate
CID 83697867
2-(cyclopropylamino)benzamide
CID 119089293
2-[(2,2-dimethylcyclopentyl)amino]-N,N-dimethylbenzamide
CID 79860587
2-(cyclopentanecarbonylamino)-N,N-dimethylbenzamide
CID 39233266
3-[(4-aminocyclohexyl)amino]-2-methylbenzamide
CID 79723896
2-[(2-amino-2-cyclopropylpropanoyl)amino]-N,N-dimethylbenzamide
CID 60867156

Frequently Asked Questions

What is the IUPAC name of 2-[(3-aminocyclopentyl)amino]-N,N-dimethylbenzamide?
The IUPAC name of 2-[(3-aminocyclopentyl)amino]-N,N-dimethylbenzamide (CID 79462007) is 2-[(3-aminocyclopentyl)amino]-N,N-dimethylbenzamide.
What is the SMILES notation for 2-[(3-aminocyclopentyl)amino]-N,N-dimethylbenzamide?
The canonical SMILES for 2-[(3-aminocyclopentyl)amino]-N,N-dimethylbenzamide is CN(C)C(=O)c1ccccc1NC1CCC(N)C1.
What is the InChIKey of 2-[(3-aminocyclopentyl)amino]-N,N-dimethylbenzamide?
The InChIKey is DRIRRJIMGTWSDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-17(2)14(18)12-5-3-4-6-13(12)16-11-8-7-10(15)9-11/h3-6,10-11,16H,7-9,15H2,1-2H3.
What are the key properties of 2-[(3-aminocyclopentyl)amino]-N,N-dimethylbenzamide?
2-[(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 2-[(3-aminocyclopentyl)amino]-N,N-dimethylbenzamide is sourced from PubChem (CID 79462007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).