N-(2-aminocyclopentyl)-2,3-dimethyl-1H-indole-5-carboxamide

C16H21N3O — CID 63251406

IUPACN-(2-aminocyclopentyl)-2,3-dimethyl-1H-indole-5-carboxamide
SMILESCc1[nH]c2ccc(C(=O)NC3CCCC3N)cc2c1C
InChIInChI=1S/C16H21N3O/c1-9-10(2)18-14-7-6-11(8-12(9)14)16(20)19-15-5-3-4-13(15)17/h6-8,13,15,18H,3-5,17H2,1-2H3,(H,19,20)
InChIKeyGORKJTOSDJEHIW-UHFFFAOYSA-N
MW271.36 g/mol
LogP2.39
Rot. Bonds2

About N-(2-aminocyclopentyl)-2,3-dimethyl-1H-indole-5-carboxamide

N-(2-aminocyclopentyl)-2,3-dimethyl-1H-indole-5-carboxamide (PubChem CID 63251406) has the molecular formula C16H21N3O and a molecular weight of 271.36 g/mol. Its IUPAC name is N-(2-aminocyclopentyl)-2,3-dimethyl-1H-indole-5-carboxamide.

Molecular Properties

Compound NameN-(2-aminocyclopentyl)-2,3-dimethyl-1H-indole-5-carboxamide
PubChem CID63251406
Molecular FormulaC16H21N3O
Molecular Weight271.36 g/mol
Exact Mass271.17
IUPAC NameN-(2-aminocyclopentyl)-2,3-dimethyl-1H-indole-5-carboxamide
SMILESCc1[nH]c2ccc(C(=O)NC3CCCC3N)cc2c1C
InChIInChI=1S/C16H21N3O/c1-9-10(2)18-14-7-6-11(8-12(9)14)16(20)19-15-5-3-4-13(15)17/h6-8,13,15,18H,3-5,17H2,1-2H3,(H,19,20)
InChIKeyGORKJTOSDJEHIW-UHFFFAOYSA-N
XLogP2.39
TPSA70.91 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 52.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

Analyze N-(2-aminocyclopentyl)-2,3-dimethyl-1H-indole-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(3S,4S)-4-ethoxy-1-methylpyrrolidin-3-yl]-2,3-dimethyl-1H-indole-5-carboxamide
CID 91836549
N-(cyclohexylmethyl)-2,3-dimethyl-1H-indole-5-carboxamide
CID 43002218
N-(2-aminocyclohexyl)-4-methylbenzamide
CID 61037352
N-(2-cyclopentylethyl)-2,3-dimethyl-1H-indole-5-carboxamide
CID 60732092
2,3-dimethyl-N-(2-methyloxan-4-yl)-1H-indole-5-carboxamide
CID 103888208
N-(2-aminocycloheptyl)-4-hydroxy-3-methylbenzamide
CID 107672030
N-(2-aminocyclohexyl)-3-fluoro-4-methylbenzamide
CID 61038354
N',N',2,3-tetramethyl-1H-indole-5-carbohydrazide
CID 78911937
N-(2-aminocycloheptyl)-4-methylsulfonylbenzamide
CID 63258076
N-(2-amino-2-methylpropyl)-2,3-dimethyl-1H-indole-5-carboxamide
CID 115303315
N-(2-aminocyclopentyl)-3-chloro-4-hydroxybenzamide
CID 63251551
N-(2-aminocyclohexyl)-4-(dimethylamino)benzamide
CID 61037234

Frequently Asked Questions

What is the IUPAC name of N-(2-aminocyclopentyl)-2,3-dimethyl-1H-indole-5-carboxamide?
The IUPAC name of N-(2-aminocyclopentyl)-2,3-dimethyl-1H-indole-5-carboxamide (CID 63251406) is N-(2-aminocyclopentyl)-2,3-dimethyl-1H-indole-5-carboxamide.
What is the SMILES notation for N-(2-aminocyclopentyl)-2,3-dimethyl-1H-indole-5-carboxamide?
The canonical SMILES for N-(2-aminocyclopentyl)-2,3-dimethyl-1H-indole-5-carboxamide is Cc1[nH]c2ccc(C(=O)NC3CCCC3N)cc2c1C.
What is the InChIKey of N-(2-aminocyclopentyl)-2,3-dimethyl-1H-indole-5-carboxamide?
The InChIKey is GORKJTOSDJEHIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O/c1-9-10(2)18-14-7-6-11(8-12(9)14)16(20)19-15-5-3-4-13(15)17/h6-8,13,15,18H,3-5,17H2,1-2H3,(H,19,20).
What are the key properties of N-(2-aminocyclopentyl)-2,3-dimethyl-1H-indole-5-carboxamide?
N-(2-aminocyclopentyl)-2,3-dimethyl-1H-indole-5-carboxamide has a molecular weight of 271.36 g/mol, XLogP of 2.39, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminocyclopentyl)-2,3-dimethyl-1H-indole-5-carboxamide is sourced from PubChem (CID 63251406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).