3-cyclopentyl-N-[[2-(hydroxymethyl)phenyl]methyl]propanamide

C16H23NO2 — CID 110902468

IUPAC3-cyclopentyl-N-[[2-(hydroxymethyl)phenyl]methyl]propanamide
SMILESO=C(CCC1CCCC1)NCc1ccccc1CO
InChIInChI=1S/C16H23NO2/c18-12-15-8-4-3-7-14(15)11-17-16(19)10-9-13-5-1-2-6-13/h3-4,7-8,13,18H,1-2,5-6,9-12H2,(H,17,19)
InChIKeyOJUYHLOLDLVHLE-UHFFFAOYSA-N
MW261.36 g/mol
LogP2.77
Rot. Bonds6

About 3-cyclopentyl-N-[[2-(hydroxymethyl)phenyl]methyl]propanamide

3-cyclopentyl-N-[[2-(hydroxymethyl)phenyl]methyl]propanamide (PubChem CID 110902468) has the molecular formula C16H23NO2 and a molecular weight of 261.36 g/mol. Its IUPAC name is 3-cyclopentyl-N-[[2-(hydroxymethyl)phenyl]methyl]propanamide.

Molecular Properties

Compound Name3-cyclopentyl-N-[[2-(hydroxymethyl)phenyl]methyl]propanamide
PubChem CID110902468
Molecular FormulaC16H23NO2
Molecular Weight261.36 g/mol
Exact Mass261.17
IUPAC Name3-cyclopentyl-N-[[2-(hydroxymethyl)phenyl]methyl]propanamide
SMILESO=C(CCC1CCCC1)NCc1ccccc1CO
InChIInChI=1S/C16H23NO2/c18-12-15-8-4-3-7-14(15)11-17-16(19)10-9-13-5-1-2-6-13/h3-4,7-8,13,18H,1-2,5-6,9-12H2,(H,17,19)
InChIKeyOJUYHLOLDLVHLE-UHFFFAOYSA-N
XLogP2.77
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.36
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-cyclopentyl-N-[2-(hydroxymethyl)phenyl]propanamide
CID 60653813
3-cyclopentyl-N-[[2-(difluoromethoxy)phenyl]methyl]propanamide
CID 86915882
3-cyclohexyl-N-[2-(2-hydroxyphenyl)ethyl]propanamide
CID 110483602
N-[[4-(chloromethyl)phenyl]methyl]-3-cyclopentylpropanamide
CID 107233470
N-[2-[3,4-bis(hydroxymethyl)phenyl]ethyl]-3-cyclohexylpropanamide
CID 156687030
3-cyclohexyl-N-[(4-fluorophenyl)methyl]propanamide
CID 803650
N-[[2-(hydroxymethyl)phenyl]methyl]-3-(2-hydroxyphenyl)propanamide
CID 110909074
N-[(2-chlorophenyl)methyl]-3-piperidin-4-ylpropanamide
CID 62212576
2-[2-[[(2-cyclohexylacetyl)amino]methyl]phenyl]acetic acid
CID 81312083
N-[[2-(hydroxymethyl)phenyl]methyl]cyclopropanecarboxamide
CID 110902492
3-cyclopentyl-N-(pyrazolo[1,5-a]pyridin-2-ylmethyl)propanamide
CID 90569470
N-[[2-(hydroxymethyl)phenyl]methyl]-3-methoxypropanamide
CID 110924169

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-N-[[2-(hydroxymethyl)phenyl]methyl]propanamide?
The IUPAC name of 3-cyclopentyl-N-[[2-(hydroxymethyl)phenyl]methyl]propanamide (CID 110902468) is 3-cyclopentyl-N-[[2-(hydroxymethyl)phenyl]methyl]propanamide.
What is the SMILES notation for 3-cyclopentyl-N-[[2-(hydroxymethyl)phenyl]methyl]propanamide?
The canonical SMILES for 3-cyclopentyl-N-[[2-(hydroxymethyl)phenyl]methyl]propanamide is O=C(CCC1CCCC1)NCc1ccccc1CO.
What is the InChIKey of 3-cyclopentyl-N-[[2-(hydroxymethyl)phenyl]methyl]propanamide?
The InChIKey is OJUYHLOLDLVHLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO2/c18-12-15-8-4-3-7-14(15)11-17-16(19)10-9-13-5-1-2-6-13/h3-4,7-8,13,18H,1-2,5-6,9-12H2,(H,17,19).
What are the key properties of 3-cyclopentyl-N-[[2-(hydroxymethyl)phenyl]methyl]propanamide?
3-cyclopentyl-N-[[2-(hydroxymethyl)phenyl]methyl]propanamide has a molecular weight of 261.36 g/mol, XLogP of 2.77, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-N-[[2-(hydroxymethyl)phenyl]methyl]propanamide is sourced from PubChem (CID 110902468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).