N-[[2-(hydroxymethyl)cyclopentyl]methyl]pyrrolidine-1-carboxamide

C12H22N2O2 — CID 79162228

IUPACN-[[2-(hydroxymethyl)cyclopentyl]methyl]pyrrolidine-1-carboxamide
SMILESO=C(NCC1CCCC1CO)N1CCCC1
InChIInChI=1S/C12H22N2O2/c15-9-11-5-3-4-10(11)8-13-12(16)14-6-1-2-7-14/h10-11,15H,1-9H2,(H,13,16)
InChIKeyTWTZVQZIDDBTEE-UHFFFAOYSA-N
MW226.32 g/mol
LogP1.20
Rot. Bonds3

About N-[[2-(hydroxymethyl)cyclopentyl]methyl]pyrrolidine-1-carboxamide

N-[[2-(hydroxymethyl)cyclopentyl]methyl]pyrrolidine-1-carboxamide (PubChem CID 79162228) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is N-[[2-(hydroxymethyl)cyclopentyl]methyl]pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-[[2-(hydroxymethyl)cyclopentyl]methyl]pyrrolidine-1-carboxamide
PubChem CID79162228
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC NameN-[[2-(hydroxymethyl)cyclopentyl]methyl]pyrrolidine-1-carboxamide
SMILESO=C(NCC1CCCC1CO)N1CCCC1
InChIInChI=1S/C12H22N2O2/c15-9-11-5-3-4-10(11)8-13-12(16)14-6-1-2-7-14/h10-11,15H,1-9H2,(H,13,16)
InChIKeyTWTZVQZIDDBTEE-UHFFFAOYSA-N
XLogP1.20
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[2-(hydroxymethyl)cyclohexyl]methyl]piperidine-1-carboxamide
CID 79156081
N-[(2-aminocyclopentyl)methyl]piperidine-1-carboxamide
CID 79155125
N-[[3-[(pyrrolidine-1-carbonylamino)methyl]cyclohexyl]methyl]pyrrolidine-1-carboxamide
CID 43834019
N-[(2-methyloxolan-3-yl)methyl]azepane-1-carboxamide
CID 114105361
N-[(4-methylpiperidin-3-yl)methyl]pyrrolidine-1-carboxamide
CID 114955817
N-[[2-(hydroxymethyl)cyclopentyl]methyl]-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 66478079
N-[(4-ethylcyclohexyl)methyl]pyrrolidine-1-carboxamide
CID 115590481
N-[(3-aminocyclohexyl)methyl]azepane-1-carboxamide
CID 106125214
N-[[2-(hydroxymethyl)cyclopentyl]methyl]-2-methyl-2-piperazin-1-ylpropanamide
CID 80551292
N-[[2-(aminomethyl)cyclohexyl]methyl]-3-methylpiperidine-1-carboxamide
CID 79163504
N-[[2-(hydroxymethyl)cyclopentyl]methyl]hexa-2,4-dienamide
CID 77103959
2-[[2-(hydroxymethyl)cyclopentyl]methylcarbamoyl]cyclopentane-1-carboxylic acid
CID 113361137

Frequently Asked Questions

What is the IUPAC name of N-[[2-(hydroxymethyl)cyclopentyl]methyl]pyrrolidine-1-carboxamide?
The IUPAC name of N-[[2-(hydroxymethyl)cyclopentyl]methyl]pyrrolidine-1-carboxamide (CID 79162228) is N-[[2-(hydroxymethyl)cyclopentyl]methyl]pyrrolidine-1-carboxamide.
What is the SMILES notation for N-[[2-(hydroxymethyl)cyclopentyl]methyl]pyrrolidine-1-carboxamide?
The canonical SMILES for N-[[2-(hydroxymethyl)cyclopentyl]methyl]pyrrolidine-1-carboxamide is O=C(NCC1CCCC1CO)N1CCCC1.
What is the InChIKey of N-[[2-(hydroxymethyl)cyclopentyl]methyl]pyrrolidine-1-carboxamide?
The InChIKey is TWTZVQZIDDBTEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c15-9-11-5-3-4-10(11)8-13-12(16)14-6-1-2-7-14/h10-11,15H,1-9H2,(H,13,16).
What are the key properties of N-[[2-(hydroxymethyl)cyclopentyl]methyl]pyrrolidine-1-carboxamide?
N-[[2-(hydroxymethyl)cyclopentyl]methyl]pyrrolidine-1-carboxamide has a molecular weight of 226.32 g/mol, XLogP of 1.20, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(hydroxymethyl)cyclopentyl]methyl]pyrrolidine-1-carboxamide is sourced from PubChem (CID 79162228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).