(1S)-N-(cyclobutylmethyl)-2,2-dimethylcyclopropane-1-carboxamide

C11H19NO — CID 130626986

IUPAC(1S)-N-(cyclobutylmethyl)-2,2-dimethylcyclopropane-1-carboxamide
SMILESCC1(C)C[C@@H]1C(=O)NCC1CCC1
InChIInChI=1S/C11H19NO/c1-11(2)6-9(11)10(13)12-7-8-4-3-5-8/h8-9H,3-7H2,1-2H3,(H,12,13)/t9-/m1/s1
InChIKeyLEESGAWADZKUEP-SECBINFHSA-N
MW181.28 g/mol
LogP1.95
Rot. Bonds3

About (1S)-N-(cyclobutylmethyl)-2,2-dimethylcyclopropane-1-carboxamide

(1S)-N-(cyclobutylmethyl)-2,2-dimethylcyclopropane-1-carboxamide (PubChem CID 130626986) has the molecular formula C11H19NO and a molecular weight of 181.28 g/mol. Its IUPAC name is (1S)-N-(cyclobutylmethyl)-2,2-dimethylcyclopropane-1-carboxamide.

Molecular Properties

Compound Name(1S)-N-(cyclobutylmethyl)-2,2-dimethylcyclopropane-1-carboxamide
PubChem CID130626986
Molecular FormulaC11H19NO
Molecular Weight181.28 g/mol
Exact Mass181.15
IUPAC Name(1S)-N-(cyclobutylmethyl)-2,2-dimethylcyclopropane-1-carboxamide
SMILESCC1(C)C[C@@H]1C(=O)NCC1CCC1
InChIInChI=1S/C11H19NO/c1-11(2)6-9(11)10(13)12-7-8-4-3-5-8/h8-9H,3-7H2,1-2H3,(H,12,13)/t9-/m1/s1
InChIKeyLEESGAWADZKUEP-SECBINFHSA-N
XLogP1.95
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (1S)-N-(cyclobutylmethyl)-2,2-dimethylcyclopropane-1-carboxamide 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-[(2-chlorocyclopentyl)methyl]-2,2-dimethylcyclopropane-1-carboxamide
CID 107003247
2-[[(2,2-dimethylcyclopropanecarbonyl)amino]methyl]cyclopentane-1-carboxylic acid
CID 107000450
N-(cyclobutylmethyl)cyclopropanecarboxamide
CID 60757387
N-[(3-chlorocyclohexyl)methyl]-2,2-dimethylcyclopentane-1-carboxamide
CID 106132007
N-(cyclopropylmethyl)spiro[2.3]hexane-2-carboxamide
CID 130606540
N-(2-fluoroethyl)-2,2-dimethylcyclopropane-1-carboxamide
CID 130635135
2-amino-N-(cyclopentylmethyl)cyclopentane-1-carboxamide
CID 64822133
N-[[1-(chloromethyl)cyclopropyl]methyl]-2,2-dimethylcyclopropane-1-carboxamide
CID 107003299
N-[(3-bromocyclopentyl)methyl]-2,2-dimethylcyclopentane-1-carboxamide
CID 106128288
N-(cyclobutylmethyl)-1-silylformamide
CID 153187562
1-(cyclobutylmethyl)-3-(cyclohexylmethyl)urea
CID 155200065
N-cyclopentyl-2,2-dimethylcyclopropane-1-carboxamide
CID 103837196

Frequently Asked Questions

What is the IUPAC name of (1S)-N-(cyclobutylmethyl)-2,2-dimethylcyclopropane-1-carboxamide?
The IUPAC name of (1S)-N-(cyclobutylmethyl)-2,2-dimethylcyclopropane-1-carboxamide (CID 130626986) is (1S)-N-(cyclobutylmethyl)-2,2-dimethylcyclopropane-1-carboxamide.
What is the SMILES notation for (1S)-N-(cyclobutylmethyl)-2,2-dimethylcyclopropane-1-carboxamide?
The canonical SMILES for (1S)-N-(cyclobutylmethyl)-2,2-dimethylcyclopropane-1-carboxamide is CC1(C)C[C@@H]1C(=O)NCC1CCC1.
What is the InChIKey of (1S)-N-(cyclobutylmethyl)-2,2-dimethylcyclopropane-1-carboxamide?
The InChIKey is LEESGAWADZKUEP-SECBINFHSA-N. The full InChI is InChI=1S/C11H19NO/c1-11(2)6-9(11)10(13)12-7-8-4-3-5-8/h8-9H,3-7H2,1-2H3,(H,12,13)/t9-/m1/s1.
What are the key properties of (1S)-N-(cyclobutylmethyl)-2,2-dimethylcyclopropane-1-carboxamide?
(1S)-N-(cyclobutylmethyl)-2,2-dimethylcyclopropane-1-carboxamide has a molecular weight of 181.28 g/mol, XLogP of 1.95, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-N-(cyclobutylmethyl)-2,2-dimethylcyclopropane-1-carboxamide is sourced from PubChem (CID 130626986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).