N-[2-(hydroxymethyl)cyclopentyl]-5-methylfuran-2-carboxamide

C12H17NO3 — CID 103759065

IUPACN-[2-(hydroxymethyl)cyclopentyl]-5-methylfuran-2-carboxamide
SMILESCc1ccc(C(=O)NC2CCCC2CO)o1
InChIInChI=1S/C12H17NO3/c1-8-5-6-11(16-8)12(15)13-10-4-2-3-9(10)7-14/h5-6,9-10,14H,2-4,7H2,1H3,(H,13,15)
InChIKeyXNOXLHUBQQZYHZ-UHFFFAOYSA-N
MW223.27 g/mol
LogP1.48
Rot. Bonds3

About N-[2-(hydroxymethyl)cyclopentyl]-5-methylfuran-2-carboxamide

N-[2-(hydroxymethyl)cyclopentyl]-5-methylfuran-2-carboxamide (PubChem CID 103759065) has the molecular formula C12H17NO3 and a molecular weight of 223.27 g/mol. Its IUPAC name is N-[2-(hydroxymethyl)cyclopentyl]-5-methylfuran-2-carboxamide.

Molecular Properties

Compound NameN-[2-(hydroxymethyl)cyclopentyl]-5-methylfuran-2-carboxamide
PubChem CID103759065
Molecular FormulaC12H17NO3
Molecular Weight223.27 g/mol
Exact Mass223.12
IUPAC NameN-[2-(hydroxymethyl)cyclopentyl]-5-methylfuran-2-carboxamide
SMILESCc1ccc(C(=O)NC2CCCC2CO)o1
InChIInChI=1S/C12H17NO3/c1-8-5-6-11(16-8)12(15)13-10-4-2-3-9(10)7-14/h5-6,9-10,14H,2-4,7H2,1H3,(H,13,15)
InChIKeyXNOXLHUBQQZYHZ-UHFFFAOYSA-N
XLogP1.48
TPSA62.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.27
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1R,2S,3S)-2,3-dimethylcyclohexyl]-5-methylfuran-2-carboxamide
CID 51969450
N-(2-carbamothioylcyclopentyl)-5-methylfuran-2-carboxamide
CID 62956749
N-[2-(hydroxymethyl)cyclopentyl]-2-(4-methylphenyl)acetamide
CID 103751406
N-(2-cyanocyclopentyl)-5-methylfuran-2-carboxamide
CID 62961798
N-[(1S,2R)-2-tert-butylcyclohexyl]-5-methylfuran-2-carboxamide
CID 27459810
2-hydroxy-N-[2-(hydroxymethyl)cyclopentyl]-5-methylbenzamide
CID 103822598
4-butyl-N-[2-(hydroxymethyl)cyclopentyl]benzamide
CID 103774443
2-amino-N-[2-(hydroxymethyl)cyclopentyl]-5-methylbenzamide
CID 114178387
4-(chloromethyl)-N-[2-(hydroxymethyl)cyclohexyl]benzamide
CID 106359879
[2-[(5-methylfuran-2-yl)methylamino]cyclopentyl]methanol
CID 115655051
4-ethoxy-N-[2-(hydroxymethyl)cyclopentyl]benzamide
CID 103751428
N-[(1S,2S)-2-[(4-fluorophenyl)methyl]cyclopentyl]-6-methyl-4-oxopyran-2-carboxamide
CID 90648014

Frequently Asked Questions

What is the IUPAC name of N-[2-(hydroxymethyl)cyclopentyl]-5-methylfuran-2-carboxamide?
The IUPAC name of N-[2-(hydroxymethyl)cyclopentyl]-5-methylfuran-2-carboxamide (CID 103759065) is N-[2-(hydroxymethyl)cyclopentyl]-5-methylfuran-2-carboxamide.
What is the SMILES notation for N-[2-(hydroxymethyl)cyclopentyl]-5-methylfuran-2-carboxamide?
The canonical SMILES for N-[2-(hydroxymethyl)cyclopentyl]-5-methylfuran-2-carboxamide is Cc1ccc(C(=O)NC2CCCC2CO)o1.
What is the InChIKey of N-[2-(hydroxymethyl)cyclopentyl]-5-methylfuran-2-carboxamide?
The InChIKey is XNOXLHUBQQZYHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO3/c1-8-5-6-11(16-8)12(15)13-10-4-2-3-9(10)7-14/h5-6,9-10,14H,2-4,7H2,1H3,(H,13,15).
What are the key properties of N-[2-(hydroxymethyl)cyclopentyl]-5-methylfuran-2-carboxamide?
N-[2-(hydroxymethyl)cyclopentyl]-5-methylfuran-2-carboxamide has a molecular weight of 223.27 g/mol, XLogP of 1.48, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(hydroxymethyl)cyclopentyl]-5-methylfuran-2-carboxamide is sourced from PubChem (CID 103759065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).