N-(2-aminocyclopentyl)-1,5-dimethylpyrrole-2-carboxamide

C12H19N3O — CID 63251565

IUPACN-(2-aminocyclopentyl)-1,5-dimethylpyrrole-2-carboxamide
SMILESCc1ccc(C(=O)NC2CCCC2N)n1C
InChIInChI=1S/C12H19N3O/c1-8-6-7-11(15(8)2)12(16)14-10-5-3-4-9(10)13/h6-7,9-10H,3-5,13H2,1-2H3,(H,14,16)
InChIKeyXCNOZCZUYXFAAR-UHFFFAOYSA-N
MW221.30 g/mol
LogP0.94
Rot. Bonds2

About N-(2-aminocyclopentyl)-1,5-dimethylpyrrole-2-carboxamide

N-(2-aminocyclopentyl)-1,5-dimethylpyrrole-2-carboxamide (PubChem CID 63251565) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is N-(2-aminocyclopentyl)-1,5-dimethylpyrrole-2-carboxamide.

Molecular Properties

Compound NameN-(2-aminocyclopentyl)-1,5-dimethylpyrrole-2-carboxamide
PubChem CID63251565
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC NameN-(2-aminocyclopentyl)-1,5-dimethylpyrrole-2-carboxamide
SMILESCc1ccc(C(=O)NC2CCCC2N)n1C
InChIInChI=1S/C12H19N3O/c1-8-6-7-11(15(8)2)12(16)14-10-5-3-4-9(10)13/h6-7,9-10H,3-5,13H2,1-2H3,(H,14,16)
InChIKeyXCNOZCZUYXFAAR-UHFFFAOYSA-N
XLogP0.94
TPSA60.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1R,2R)-2-aminocyclohexyl]-1,5-dimethylpyrrole-2-carboxamide
CID 93452032
N-(2-hydroxycycloheptyl)-1,5-dimethylpyrrole-2-carboxamide
CID 113394900
1,5-dimethyl-N-[4-(methylamino)cyclohexyl]pyrrole-2-carboxamide
CID 79110293
cis-(1R,3S)-3-[(1,5-dimethylpyrrole-2-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 106320098
N-(2-aminocyclohexyl)-4-methylbenzamide
CID 61037352
N-(3-azabicyclo[3.1.0]hexan-6-yl)-1,5-dimethylpyrrole-2-carboxamide
CID 43594241
N-[(1R,2R)-2-aminocyclohexyl]-1-ethylpyrrole-2-carboxamide
CID 93451491
N-(2-aminocyclohexyl)-3-ethyl-1-methylpyrazole-5-carboxamide
CID 66121735
1,5-dimethylpyrrole-2-carbohydrazide;hydrochloride
CID 130653632
N-(2-aminocyclohexyl)-5-methylfuran-3-carboxamide
CID 114821924
N-(2-aminocyclopentyl)-4-chloro-1-propan-2-ylpyrrole-2-carboxamide
CID 63251778
2-[(1,5-dimethylpyrrole-2-carbonyl)amino]-1-methylcyclohexane-1-carboxylic acid
CID 83213821

Frequently Asked Questions

What is the IUPAC name of N-(2-aminocyclopentyl)-1,5-dimethylpyrrole-2-carboxamide?
The IUPAC name of N-(2-aminocyclopentyl)-1,5-dimethylpyrrole-2-carboxamide (CID 63251565) is N-(2-aminocyclopentyl)-1,5-dimethylpyrrole-2-carboxamide.
What is the SMILES notation for N-(2-aminocyclopentyl)-1,5-dimethylpyrrole-2-carboxamide?
The canonical SMILES for N-(2-aminocyclopentyl)-1,5-dimethylpyrrole-2-carboxamide is Cc1ccc(C(=O)NC2CCCC2N)n1C.
What is the InChIKey of N-(2-aminocyclopentyl)-1,5-dimethylpyrrole-2-carboxamide?
The InChIKey is XCNOZCZUYXFAAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-8-6-7-11(15(8)2)12(16)14-10-5-3-4-9(10)13/h6-7,9-10H,3-5,13H2,1-2H3,(H,14,16).
What are the key properties of N-(2-aminocyclopentyl)-1,5-dimethylpyrrole-2-carboxamide?
N-(2-aminocyclopentyl)-1,5-dimethylpyrrole-2-carboxamide has a molecular weight of 221.30 g/mol, XLogP of 0.94, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminocyclopentyl)-1,5-dimethylpyrrole-2-carboxamide is sourced from PubChem (CID 63251565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).