N-(2-hydroxycyclopentyl)-2-(hydroxymethyl)butanamide

C10H19NO3 — CID 70915127

IUPACN-(2-hydroxycyclopentyl)-2-(hydroxymethyl)butanamide
SMILESCCC(CO)C(=O)NC1CCCC1O
InChIInChI=1S/C10H19NO3/c1-2-7(6-12)10(14)11-8-4-3-5-9(8)13/h7-9,12-13H,2-6H2,1H3,(H,11,14)
InChIKeyPDAWIXGSSPTOED-UHFFFAOYSA-N
MW201.27 g/mol
LogP0.03
Rot. Bonds4

About N-(2-hydroxycyclopentyl)-2-(hydroxymethyl)butanamide

N-(2-hydroxycyclopentyl)-2-(hydroxymethyl)butanamide (PubChem CID 70915127) has the molecular formula C10H19NO3 and a molecular weight of 201.27 g/mol. Its IUPAC name is N-(2-hydroxycyclopentyl)-2-(hydroxymethyl)butanamide.

Molecular Properties

Compound NameN-(2-hydroxycyclopentyl)-2-(hydroxymethyl)butanamide
PubChem CID70915127
Molecular FormulaC10H19NO3
Molecular Weight201.27 g/mol
Exact Mass201.14
IUPAC NameN-(2-hydroxycyclopentyl)-2-(hydroxymethyl)butanamide
SMILESCCC(CO)C(=O)NC1CCCC1O
InChIInChI=1S/C10H19NO3/c1-2-7(6-12)10(14)11-8-4-3-5-9(8)13/h7-9,12-13H,2-6H2,1H3,(H,11,14)
InChIKeyPDAWIXGSSPTOED-UHFFFAOYSA-N
XLogP0.03
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 50.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-(aminomethyl)-N-[(1R,2R)-2-hydroxycyclohexyl]butanamide
CID 107221949
N-[(1S,2S)-2-hydroxycyclohexyl]-2-methylbutanamide
CID 104957388
N-[(1R,2R)-2-hydroxycyclopentyl]-2-methylpropanamide
CID 138722563
2-amino-N-[(1S,2S)-2-hydroxycyclohexyl]butanamide
CID 107221502
(2S)-N-[(1S,2R)-2-hydroxycyclohexyl]-2-methylsulfanylbutanamide
CID 124855975
(2S)-2-amino-N-[(1R,2R)-2-hydroxycyclohexyl]-3-methylpentanamide
CID 107221962
2-(aminomethyl)-N-[(1S,2S)-2-hydroxycyclohexyl]-4,4-dimethylpentanamide
CID 107472961
N-(2-carbamothioylcyclopentyl)-2-ethylbutanamide
CID 62956227
2-(1-hydroxybutan-2-ylamino)cyclopentan-1-ol
CID 60713643
N-(2-hydroxycyclopentyl)butanamide
CID 72951810
trans-(1S,2S)-2-(1-hydroxybutan-2-ylamino)cyclopentan-1-ol
CID 102733097
N-[(1R,2S)-2-hydroxycyclopentyl]acetamide
CID 14988808

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxycyclopentyl)-2-(hydroxymethyl)butanamide?
The IUPAC name of N-(2-hydroxycyclopentyl)-2-(hydroxymethyl)butanamide (CID 70915127) is N-(2-hydroxycyclopentyl)-2-(hydroxymethyl)butanamide.
What is the SMILES notation for N-(2-hydroxycyclopentyl)-2-(hydroxymethyl)butanamide?
The canonical SMILES for N-(2-hydroxycyclopentyl)-2-(hydroxymethyl)butanamide is CCC(CO)C(=O)NC1CCCC1O.
What is the InChIKey of N-(2-hydroxycyclopentyl)-2-(hydroxymethyl)butanamide?
The InChIKey is PDAWIXGSSPTOED-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO3/c1-2-7(6-12)10(14)11-8-4-3-5-9(8)13/h7-9,12-13H,2-6H2,1H3,(H,11,14).
What are the key properties of N-(2-hydroxycyclopentyl)-2-(hydroxymethyl)butanamide?
N-(2-hydroxycyclopentyl)-2-(hydroxymethyl)butanamide has a molecular weight of 201.27 g/mol, XLogP of 0.03, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxycyclopentyl)-2-(hydroxymethyl)butanamide is sourced from PubChem (CID 70915127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).