N-(2-cyclopentyl-2-hydroxyethyl)furan-3-carboxamide

C12H17NO3 — CID 111426324

IUPACN-(2-cyclopentyl-2-hydroxyethyl)furan-3-carboxamide
SMILESO=C(NCC(O)C1CCCC1)c1ccoc1
InChIInChI=1S/C12H17NO3/c14-11(9-3-1-2-4-9)7-13-12(15)10-5-6-16-8-10/h5-6,8-9,11,14H,1-4,7H2,(H,13,15)
InChIKeyHJGSFEQKIALYNY-UHFFFAOYSA-N
MW223.27 g/mol
LogP1.56
Rot. Bonds4

About N-(2-cyclopentyl-2-hydroxyethyl)furan-3-carboxamide

N-(2-cyclopentyl-2-hydroxyethyl)furan-3-carboxamide (PubChem CID 111426324) has the molecular formula C12H17NO3 and a molecular weight of 223.27 g/mol. Its IUPAC name is N-(2-cyclopentyl-2-hydroxyethyl)furan-3-carboxamide.

Molecular Properties

Compound NameN-(2-cyclopentyl-2-hydroxyethyl)furan-3-carboxamide
PubChem CID111426324
Molecular FormulaC12H17NO3
Molecular Weight223.27 g/mol
Exact Mass223.12
IUPAC NameN-(2-cyclopentyl-2-hydroxyethyl)furan-3-carboxamide
SMILESO=C(NCC(O)C1CCCC1)c1ccoc1
InChIInChI=1S/C12H17NO3/c14-11(9-3-1-2-4-9)7-13-12(15)10-5-6-16-8-10/h5-6,8-9,11,14H,1-4,7H2,(H,13,15)
InChIKeyHJGSFEQKIALYNY-UHFFFAOYSA-N
XLogP1.56
TPSA62.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.27
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-cyclopropyl-2-hydroxyethyl)furan-3-carboxamide
CID 63294562
N-(2-chloro-2-cyclopropylethyl)furan-3-carboxamide
CID 114305001
N-[(2S)-2-cyclohexyl-2-hydroxyethyl]thiophene-3-carboxamide
CID 95292148
N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-4-phenylbenzamide
CID 95367502
N-(2-cyclopentyl-2-hydroxyethyl)-3-methylbenzamide
CID 111425752
N-(2-cyclopentyl-2-hydroxyethyl)-2-methylfuran-3-carboxamide
CID 111426337
3-N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-1-N-methylbenzene-1,3-dicarboxamide
CID 97218721
N-(2-cyclohexyl-2-hydroxyethyl)-4-propylbenzamide
CID 90498765
2-cyclohexyl-1-(furan-3-yl)-2-hydroxyethanone
CID 103457678
N-(4-hydroxy-2-methylpentyl)furan-3-carboxamide
CID 111447081
N-[2-(cyclopentylmethylamino)-2-oxoethyl]furan-3-carboxamide
CID 38304482
N-(2-cyclopentyl-2-hydroxyethyl)-2,3-dihydro-1-benzofuran-5-carboxamide
CID 111426308

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopentyl-2-hydroxyethyl)furan-3-carboxamide?
The IUPAC name of N-(2-cyclopentyl-2-hydroxyethyl)furan-3-carboxamide (CID 111426324) is N-(2-cyclopentyl-2-hydroxyethyl)furan-3-carboxamide.
What is the SMILES notation for N-(2-cyclopentyl-2-hydroxyethyl)furan-3-carboxamide?
The canonical SMILES for N-(2-cyclopentyl-2-hydroxyethyl)furan-3-carboxamide is O=C(NCC(O)C1CCCC1)c1ccoc1.
What is the InChIKey of N-(2-cyclopentyl-2-hydroxyethyl)furan-3-carboxamide?
The InChIKey is HJGSFEQKIALYNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO3/c14-11(9-3-1-2-4-9)7-13-12(15)10-5-6-16-8-10/h5-6,8-9,11,14H,1-4,7H2,(H,13,15).
What are the key properties of N-(2-cyclopentyl-2-hydroxyethyl)furan-3-carboxamide?
N-(2-cyclopentyl-2-hydroxyethyl)furan-3-carboxamide has a molecular weight of 223.27 g/mol, XLogP of 1.56, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopentyl-2-hydroxyethyl)furan-3-carboxamide is sourced from PubChem (CID 111426324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).