N-[(1-hydroxycyclopentyl)methyl]-N-methylprop-2-ynamide

C10H15NO2 — CID 115764401

IUPACN-[(1-hydroxycyclopentyl)methyl]-N-methylprop-2-ynamide
SMILESC#CC(=O)N(C)CC1(O)CCCC1
InChIInChI=1S/C10H15NO2/c1-3-9(12)11(2)8-10(13)6-4-5-7-10/h1,13H,4-8H2,2H3
InChIKeyJGGXYGLJVSIUOL-UHFFFAOYSA-N
MW181.23 g/mol
LogP0.38
Rot. Bonds2

About N-[(1-hydroxycyclopentyl)methyl]-N-methylprop-2-ynamide

N-[(1-hydroxycyclopentyl)methyl]-N-methylprop-2-ynamide (PubChem CID 115764401) has the molecular formula C10H15NO2 and a molecular weight of 181.23 g/mol. Its IUPAC name is N-[(1-hydroxycyclopentyl)methyl]-N-methylprop-2-ynamide.

Molecular Properties

Compound NameN-[(1-hydroxycyclopentyl)methyl]-N-methylprop-2-ynamide
PubChem CID115764401
Molecular FormulaC10H15NO2
Molecular Weight181.23 g/mol
Exact Mass181.11
IUPAC NameN-[(1-hydroxycyclopentyl)methyl]-N-methylprop-2-ynamide
SMILESC#CC(=O)N(C)CC1(O)CCCC1
InChIInChI=1S/C10H15NO2/c1-3-9(12)11(2)8-10(13)6-4-5-7-10/h1,13H,4-8H2,2H3
InChIKeyJGGXYGLJVSIUOL-UHFFFAOYSA-N
XLogP0.38
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.23
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-[(1-hydroxycyclopentyl)methyl]-N-methylprop-2-ynamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(1-hydroxycyclopentyl)methyl]-N-methylbut-2-ynamide
CID 107262082
4-[(1-hydroxycyclopentyl)methyl-methylcarbamoyl]cyclohexane-1-carboxylic acid
CID 114951146
3-chloro-N-[(1-hydroxycyclopentyl)methyl]-N,2,2-trimethylpropanamide
CID 114948691
5-hydroxy-N-[(1-hydroxycyclopentyl)methyl]-N-methylpentanamide
CID 114953852
1-cyano-N-[(1-hydroxycyclopentyl)methyl]-N-methylcyclohexane-1-carboxamide
CID 115759979
3-[(1-hydroxycyclopentyl)methyl-methylcarbamoyl]-2,2-dimethylcyclopropane-1-carboxylic acid
CID 114948610
N-[(1-hydroxycyclopentyl)methyl]-N-methyl-3-methylsulfonylpropanamide
CID 115760608
(2R)-2-amino-N-[(1-hydroxycyclopentyl)methyl]-N-methylpropanamide
CID 104985327
2-[acetyl(methyl)amino]-N-[(1-hydroxycyclopentyl)methyl]-N-methylacetamide
CID 115759885
4-[(1-hydroxycyclopentyl)methyl-methylamino]-2,3-dimethyl-4-oxobutanoic acid
CID 103499357
2,2,3,3,3-pentafluoro-N-[(1-hydroxycyclopentyl)methyl]-N-methylpropanamide
CID 114037872
3-amino-N-[(1-hydroxycyclopentyl)methyl]-N-methylcyclopentane-1-carboxamide
CID 114949026

Frequently Asked Questions

What is the IUPAC name of N-[(1-hydroxycyclopentyl)methyl]-N-methylprop-2-ynamide?
The IUPAC name of N-[(1-hydroxycyclopentyl)methyl]-N-methylprop-2-ynamide (CID 115764401) is N-[(1-hydroxycyclopentyl)methyl]-N-methylprop-2-ynamide.
What is the SMILES notation for N-[(1-hydroxycyclopentyl)methyl]-N-methylprop-2-ynamide?
The canonical SMILES for N-[(1-hydroxycyclopentyl)methyl]-N-methylprop-2-ynamide is C#CC(=O)N(C)CC1(O)CCCC1.
What is the InChIKey of N-[(1-hydroxycyclopentyl)methyl]-N-methylprop-2-ynamide?
The InChIKey is JGGXYGLJVSIUOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2/c1-3-9(12)11(2)8-10(13)6-4-5-7-10/h1,13H,4-8H2,2H3.
What are the key properties of N-[(1-hydroxycyclopentyl)methyl]-N-methylprop-2-ynamide?
N-[(1-hydroxycyclopentyl)methyl]-N-methylprop-2-ynamide has a molecular weight of 181.23 g/mol, XLogP of 0.38, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-hydroxycyclopentyl)methyl]-N-methylprop-2-ynamide is sourced from PubChem (CID 115764401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).