1-cyclopentyl-N-[(2-hydroxycyclohexyl)methyl]pyrrole-2-carboxamide

C17H26N2O2 — CID 110007316

IUPAC1-cyclopentyl-N-[(2-hydroxycyclohexyl)methyl]pyrrole-2-carboxamide
SMILESO=C(NCC1CCCCC1O)c1cccn1C1CCCC1
InChIInChI=1S/C17H26N2O2/c20-16-10-4-1-6-13(16)12-18-17(21)15-9-5-11-19(15)14-7-2-3-8-14/h5,9,11,13-14,16,20H,1-4,6-8,10,12H2,(H,18,21)
InChIKeyHZVLUWLVDCZWTI-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.88
Rot. Bonds4

About 1-cyclopentyl-N-[(2-hydroxycyclohexyl)methyl]pyrrole-2-carboxamide

1-cyclopentyl-N-[(2-hydroxycyclohexyl)methyl]pyrrole-2-carboxamide (PubChem CID 110007316) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 1-cyclopentyl-N-[(2-hydroxycyclohexyl)methyl]pyrrole-2-carboxamide.

Molecular Properties

Compound Name1-cyclopentyl-N-[(2-hydroxycyclohexyl)methyl]pyrrole-2-carboxamide
PubChem CID110007316
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name1-cyclopentyl-N-[(2-hydroxycyclohexyl)methyl]pyrrole-2-carboxamide
SMILESO=C(NCC1CCCCC1O)c1cccn1C1CCCC1
InChIInChI=1S/C17H26N2O2/c20-16-10-4-1-6-13(16)12-18-17(21)15-9-5-11-19(15)14-7-2-3-8-14/h5,9,11,13-14,16,20H,1-4,6-8,10,12H2,(H,18,21)
InChIKeyHZVLUWLVDCZWTI-UHFFFAOYSA-N
XLogP2.88
TPSA54.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopropyl-N-(pyrrolidin-2-ylmethyl)pyrrole-2-carboxamide
CID 62541280
1-cyclobutyl-N-(2-hydroxycycloheptyl)pyrrole-2-carboxamide
CID 114609767
1-cyclopropyl-N-ethylpyrrole-2-carboxamide
CID 130688583
1-cyclobutyl-N-[(1-hydroxycyclohexyl)methyl]pyrrole-2-carboxamide
CID 114609636
1-cyclobutyl-N-(2-cyclopropyl-2-hydroxyethyl)pyrrole-2-carboxamide
CID 114609590
1-cyclopropyl-N-(2-hydroxyethyl)pyrrole-2-carboxamide
CID 43639342
1-cyclobutyl-N-[(4-hydroxyphenyl)methyl]pyrrole-2-carboxamide
CID 114609401
1-cyclobutyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrrole-2-carboxamide
CID 104971656
1-cyclohexylpyrrole-2-carboxamide
CID 150262171
1-cyclopropyl-N-(pyrrolidin-3-ylmethyl)pyrrole-2-carboxamide
CID 80564395
1-cyclobutyl-N-[[1-(hydroxymethyl)cyclopropyl]methyl]pyrrole-2-carboxamide
CID 114609745
1-cyclobutyl-N-(2-hydroxy-2-methylbutyl)pyrrole-2-carboxamide
CID 114609625

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-[(2-hydroxycyclohexyl)methyl]pyrrole-2-carboxamide?
The IUPAC name of 1-cyclopentyl-N-[(2-hydroxycyclohexyl)methyl]pyrrole-2-carboxamide (CID 110007316) is 1-cyclopentyl-N-[(2-hydroxycyclohexyl)methyl]pyrrole-2-carboxamide.
What is the SMILES notation for 1-cyclopentyl-N-[(2-hydroxycyclohexyl)methyl]pyrrole-2-carboxamide?
The canonical SMILES for 1-cyclopentyl-N-[(2-hydroxycyclohexyl)methyl]pyrrole-2-carboxamide is O=C(NCC1CCCCC1O)c1cccn1C1CCCC1.
What is the InChIKey of 1-cyclopentyl-N-[(2-hydroxycyclohexyl)methyl]pyrrole-2-carboxamide?
The InChIKey is HZVLUWLVDCZWTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c20-16-10-4-1-6-13(16)12-18-17(21)15-9-5-11-19(15)14-7-2-3-8-14/h5,9,11,13-14,16,20H,1-4,6-8,10,12H2,(H,18,21).
What are the key properties of 1-cyclopentyl-N-[(2-hydroxycyclohexyl)methyl]pyrrole-2-carboxamide?
1-cyclopentyl-N-[(2-hydroxycyclohexyl)methyl]pyrrole-2-carboxamide has a molecular weight of 290.41 g/mol, XLogP of 2.88, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-[(2-hydroxycyclohexyl)methyl]pyrrole-2-carboxamide is sourced from PubChem (CID 110007316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).