N-(2-cyclobutyl-2-methylpropyl)-1-(hydroxymethyl)cyclopropane-1-carboxamide

C13H23NO2 — CID 115182505

IUPACN-(2-cyclobutyl-2-methylpropyl)-1-(hydroxymethyl)cyclopropane-1-carboxamide
SMILESCC(C)(CNC(=O)C1(CO)CC1)C1CCC1
InChIInChI=1S/C13H23NO2/c1-12(2,10-4-3-5-10)8-14-11(16)13(9-15)6-7-13/h10,15H,3-9H2,1-2H3,(H,14,16)
InChIKeyWBTPNKHTPXAILT-UHFFFAOYSA-N
MW225.33 g/mol
LogP1.70
Rot. Bonds5

About N-(2-cyclobutyl-2-methylpropyl)-1-(hydroxymethyl)cyclopropane-1-carboxamide

N-(2-cyclobutyl-2-methylpropyl)-1-(hydroxymethyl)cyclopropane-1-carboxamide (PubChem CID 115182505) has the molecular formula C13H23NO2 and a molecular weight of 225.33 g/mol. Its IUPAC name is N-(2-cyclobutyl-2-methylpropyl)-1-(hydroxymethyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(2-cyclobutyl-2-methylpropyl)-1-(hydroxymethyl)cyclopropane-1-carboxamide
PubChem CID115182505
Molecular FormulaC13H23NO2
Molecular Weight225.33 g/mol
Exact Mass225.17
IUPAC NameN-(2-cyclobutyl-2-methylpropyl)-1-(hydroxymethyl)cyclopropane-1-carboxamide
SMILESCC(C)(CNC(=O)C1(CO)CC1)C1CCC1
InChIInChI=1S/C13H23NO2/c1-12(2,10-4-3-5-10)8-14-11(16)13(9-15)6-7-13/h10,15H,3-9H2,1-2H3,(H,14,16)
InChIKeyWBTPNKHTPXAILT-UHFFFAOYSA-N
XLogP1.70
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.33
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(hydroxymethyl)-N-[2-methyl-2-(oxan-4-yl)propyl]cyclopropane-1-carboxamide
CID 115182500
1-cyano-N-(2-cyclobutyl-2-methylpropyl)cyclopropane-1-carboxamide
CID 115181795
1-(aminomethyl)-N-[2-methyl-2-(oxan-4-yl)propyl]cyclobutane-1-carboxamide
CID 115183609
N-(2-cyclobutyl-2-methylpropyl)-2-sulfanylacetamide
CID 115167608
(E)-4-[(2-cyclobutyl-2-methylpropyl)amino]-4-oxobut-2-enoic acid
CID 115177367
N-(2-cyclopentyl-2-methylpropyl)-3-hydroxypropanamide
CID 115139545
4-[(2-cyclopentyl-2-methylpropyl)amino]-2,2-dimethyl-4-oxobutanoic acid
CID 115165302
3-cyano-N-(2-cyclohexyl-2-methylpropyl)oxetane-3-carboxamide
CID 115184886
N-[2-(4-fluorophenyl)-2-methylpropyl]-1-(hydroxymethyl)cyclopropane-1-carboxamide
CID 115182483
N-[2-(4-bromophenyl)-2-methylpropyl]-1-(hydroxymethyl)cyclopropane-1-carboxamide
CID 115182484
1-[(2-cyclobutyl-2-methylpropyl)amino]propan-2-one
CID 115235348
N-(2-cyclohexyl-2-methylpropyl)-2-(hydroxymethyl)butanamide
CID 115186801

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclobutyl-2-methylpropyl)-1-(hydroxymethyl)cyclopropane-1-carboxamide?
The IUPAC name of N-(2-cyclobutyl-2-methylpropyl)-1-(hydroxymethyl)cyclopropane-1-carboxamide (CID 115182505) is N-(2-cyclobutyl-2-methylpropyl)-1-(hydroxymethyl)cyclopropane-1-carboxamide.
What is the SMILES notation for N-(2-cyclobutyl-2-methylpropyl)-1-(hydroxymethyl)cyclopropane-1-carboxamide?
The canonical SMILES for N-(2-cyclobutyl-2-methylpropyl)-1-(hydroxymethyl)cyclopropane-1-carboxamide is CC(C)(CNC(=O)C1(CO)CC1)C1CCC1.
What is the InChIKey of N-(2-cyclobutyl-2-methylpropyl)-1-(hydroxymethyl)cyclopropane-1-carboxamide?
The InChIKey is WBTPNKHTPXAILT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO2/c1-12(2,10-4-3-5-10)8-14-11(16)13(9-15)6-7-13/h10,15H,3-9H2,1-2H3,(H,14,16).
What are the key properties of N-(2-cyclobutyl-2-methylpropyl)-1-(hydroxymethyl)cyclopropane-1-carboxamide?
N-(2-cyclobutyl-2-methylpropyl)-1-(hydroxymethyl)cyclopropane-1-carboxamide has a molecular weight of 225.33 g/mol, XLogP of 1.70, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclobutyl-2-methylpropyl)-1-(hydroxymethyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 115182505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).