N-[1-(hydroxymethyl)cyclopentyl]heptanamide

C13H25NO2 — CID 62518617

IUPACN-[1-(hydroxymethyl)cyclopentyl]heptanamide
SMILESCCCCCCC(=O)NC1(CO)CCCC1
InChIInChI=1S/C13H25NO2/c1-2-3-4-5-8-12(16)14-13(11-15)9-6-7-10-13/h15H,2-11H2,1H3,(H,14,16)
InChIKeyUWWUGWUDJFDOMJ-UHFFFAOYSA-N
MW227.35 g/mol
LogP2.38
Rot. Bonds7

About N-[1-(hydroxymethyl)cyclopentyl]heptanamide

N-[1-(hydroxymethyl)cyclopentyl]heptanamide (PubChem CID 62518617) has the molecular formula C13H25NO2 and a molecular weight of 227.35 g/mol. Its IUPAC name is N-[1-(hydroxymethyl)cyclopentyl]heptanamide.

Molecular Properties

Compound NameN-[1-(hydroxymethyl)cyclopentyl]heptanamide
PubChem CID62518617
Molecular FormulaC13H25NO2
Molecular Weight227.35 g/mol
Exact Mass227.19
IUPAC NameN-[1-(hydroxymethyl)cyclopentyl]heptanamide
SMILESCCCCCCC(=O)NC1(CO)CCCC1
InChIInChI=1S/C13H25NO2/c1-2-3-4-5-8-12(16)14-13(11-15)9-6-7-10-13/h15H,2-11H2,1H3,(H,14,16)
InChIKeyUWWUGWUDJFDOMJ-UHFFFAOYSA-N
XLogP2.38
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[1-(hydroxymethyl)cyclobutyl]nonanamide
CID 115878113
N-[1-(hydroxymethyl)cyclopropyl]pentanamide
CID 115764875
N-[1-(hydroxymethyl)-4-methylcyclohexyl]decanamide
CID 63404095
N-[1-(bromomethyl)cyclopentyl]hexanamide
CID 114311357
6-amino-N-[1-(hydroxymethyl)cyclohexyl]hexanamide
CID 55086608
2-[1-(hexanoylamino)cyclobutyl]acetic acid
CID 79848224
1-(nonanoylamino)cyclohexane-1-carboxylic acid
CID 43350921
1-(nonanoylamino)cycloheptane-1-carboxylic acid
CID 43172633
N-[5-(hydroxymethyl)-2,2-dimethyl-1,3-dioxan-5-yl]octadecanamide
CID 129305066
1-(hexanoylamino)cycloheptane-1-carboxylic acid
CID 43341577
5-amino-N-[1-(hydroxymethyl)cyclopentyl]hexanamide
CID 82851755
N-[1-(chloromethyl)-3-methylcyclohexyl]nonanamide
CID 114304010

Frequently Asked Questions

What is the IUPAC name of N-[1-(hydroxymethyl)cyclopentyl]heptanamide?
The IUPAC name of N-[1-(hydroxymethyl)cyclopentyl]heptanamide (CID 62518617) is N-[1-(hydroxymethyl)cyclopentyl]heptanamide.
What is the SMILES notation for N-[1-(hydroxymethyl)cyclopentyl]heptanamide?
The canonical SMILES for N-[1-(hydroxymethyl)cyclopentyl]heptanamide is CCCCCCC(=O)NC1(CO)CCCC1.
What is the InChIKey of N-[1-(hydroxymethyl)cyclopentyl]heptanamide?
The InChIKey is UWWUGWUDJFDOMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO2/c1-2-3-4-5-8-12(16)14-13(11-15)9-6-7-10-13/h15H,2-11H2,1H3,(H,14,16).
What are the key properties of N-[1-(hydroxymethyl)cyclopentyl]heptanamide?
N-[1-(hydroxymethyl)cyclopentyl]heptanamide has a molecular weight of 227.35 g/mol, XLogP of 2.38, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(hydroxymethyl)cyclopentyl]heptanamide is sourced from PubChem (CID 62518617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).