N-[(2-hydroxycyclopentyl)methyl]-2-methyl-3-phenylpropanamide

C16H23NO2 — CID 111471021

IUPACN-[(2-hydroxycyclopentyl)methyl]-2-methyl-3-phenylpropanamide
SMILESCC(Cc1ccccc1)C(=O)NCC1CCCC1O
InChIInChI=1S/C16H23NO2/c1-12(10-13-6-3-2-4-7-13)16(19)17-11-14-8-5-9-15(14)18/h2-4,6-7,12,14-15,18H,5,8-11H2,1H3,(H,17,19)
InChIKeyICPAZZNHFSROGI-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.14
Rot. Bonds5

About N-[(2-hydroxycyclopentyl)methyl]-2-methyl-3-phenylpropanamide

N-[(2-hydroxycyclopentyl)methyl]-2-methyl-3-phenylpropanamide (PubChem CID 111471021) has the molecular formula C16H23NO2 and a molecular weight of 261.37 g/mol. Its IUPAC name is N-[(2-hydroxycyclopentyl)methyl]-2-methyl-3-phenylpropanamide.

Molecular Properties

Compound NameN-[(2-hydroxycyclopentyl)methyl]-2-methyl-3-phenylpropanamide
PubChem CID111471021
Molecular FormulaC16H23NO2
Molecular Weight261.37 g/mol
Exact Mass261.17
IUPAC NameN-[(2-hydroxycyclopentyl)methyl]-2-methyl-3-phenylpropanamide
SMILESCC(Cc1ccccc1)C(=O)NCC1CCCC1O
InChIInChI=1S/C16H23NO2/c1-12(10-13-6-3-2-4-7-13)16(19)17-11-14-8-5-9-15(14)18/h2-4,6-7,12,14-15,18H,5,8-11H2,1H3,(H,17,19)
InChIKeyICPAZZNHFSROGI-UHFFFAOYSA-N
XLogP2.14
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-N-[[(1S,2R)-2-hydroxycyclopentyl]methyl]-2-phenylpropanamide
CID 129445920
N-[(2-hydroxycyclohexyl)methyl]-2-methoxy-2-phenylacetamide
CID 64929493
N-ethyl-2-methyl-3-phenylpropanamide
CID 58846627
N-[(2S)-1-[[(1S,2S)-2-hydroxycyclopentyl]methylamino]-3-methyl-1-oxobutan-2-yl]furan-2-carboxamide
CID 95781275
2-(2-benzyl-3-methylbutyl)cyclopentan-1-ol
CID 57078644
(2S)-2-amino-N-[(2-hydroxycyclopentyl)methyl]-3-methylbutanamide
CID 79025652
2-chloro-N-[(2-hydroxycyclohexyl)methyl]propanamide
CID 64929109
(2R)-2-amino-N-[(2-hydroxycyclohexyl)methyl]propanamide
CID 79001441
N-[(2-methylcyclopentyl)methyl]-2,2-diphenylacetamide
CID 167190715
(2S)-N-[3-[(1R,2S)-2-hydroxycyclopentyl]propyl]-2-phenylpropanamide
CID 99856024
2-(3-aminophenyl)-N-[(2-hydroxycyclohexyl)methyl]propanamide
CID 106591529
N-butyl-2-methyl-3-phenylpropanamide
CID 70830385

Frequently Asked Questions

What is the IUPAC name of N-[(2-hydroxycyclopentyl)methyl]-2-methyl-3-phenylpropanamide?
The IUPAC name of N-[(2-hydroxycyclopentyl)methyl]-2-methyl-3-phenylpropanamide (CID 111471021) is N-[(2-hydroxycyclopentyl)methyl]-2-methyl-3-phenylpropanamide.
What is the SMILES notation for N-[(2-hydroxycyclopentyl)methyl]-2-methyl-3-phenylpropanamide?
The canonical SMILES for N-[(2-hydroxycyclopentyl)methyl]-2-methyl-3-phenylpropanamide is CC(Cc1ccccc1)C(=O)NCC1CCCC1O.
What is the InChIKey of N-[(2-hydroxycyclopentyl)methyl]-2-methyl-3-phenylpropanamide?
The InChIKey is ICPAZZNHFSROGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO2/c1-12(10-13-6-3-2-4-7-13)16(19)17-11-14-8-5-9-15(14)18/h2-4,6-7,12,14-15,18H,5,8-11H2,1H3,(H,17,19).
What are the key properties of N-[(2-hydroxycyclopentyl)methyl]-2-methyl-3-phenylpropanamide?
N-[(2-hydroxycyclopentyl)methyl]-2-methyl-3-phenylpropanamide has a molecular weight of 261.37 g/mol, XLogP of 2.14, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-hydroxycyclopentyl)methyl]-2-methyl-3-phenylpropanamide is sourced from PubChem (CID 111471021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).