N-(3-hydroxycyclobutyl)-1-methylcyclopropane-1-carboxamide

C9H15NO2 — CID 126981151

IUPACN-(3-hydroxycyclobutyl)-1-methylcyclopropane-1-carboxamide
SMILESCC1(C(=O)NC2CC(O)C2)CC1
InChIInChI=1S/C9H15NO2/c1-9(2-3-9)8(12)10-6-4-7(11)5-6/h6-7,11H,2-5H2,1H3,(H,10,12)
InChIKeyCDJSSNSMMSDIPP-UHFFFAOYSA-N
MW169.22 g/mol
LogP0.43
Rot. Bonds2

About N-(3-hydroxycyclobutyl)-1-methylcyclopropane-1-carboxamide

N-(3-hydroxycyclobutyl)-1-methylcyclopropane-1-carboxamide (PubChem CID 126981151) has the molecular formula C9H15NO2 and a molecular weight of 169.22 g/mol. Its IUPAC name is N-(3-hydroxycyclobutyl)-1-methylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(3-hydroxycyclobutyl)-1-methylcyclopropane-1-carboxamide
PubChem CID126981151
Molecular FormulaC9H15NO2
Molecular Weight169.22 g/mol
Exact Mass169.11
IUPAC NameN-(3-hydroxycyclobutyl)-1-methylcyclopropane-1-carboxamide
SMILESCC1(C(=O)NC2CC(O)C2)CC1
InChIInChI=1S/C9H15NO2/c1-9(2-3-9)8(12)10-6-4-7(11)5-6/h6-7,11H,2-5H2,1H3,(H,10,12)
InChIKeyCDJSSNSMMSDIPP-UHFFFAOYSA-N
XLogP0.43
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.22
LogP ≤ 50.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclohexyl-1-methylcyclopropane-1-carboxamide
CID 130162659
N-(3-hydroxycyclohexyl)-4-methylpiperidine-4-carboxamide
CID 55179480
N-(3-hydroxy-2,2-dimethylcyclobutyl)-1-methylcyclopropane-1-carboxamide
CID 126973302
2-[3-[(1-methylcyclopropanecarbonyl)amino]cyclopentyl]acetic acid
CID 165449455
N-(3-hydroxycyclobutyl)-3,5-dimethyladamantane-1-carboxamide
CID 79998220
1-methyl-N-(1-methylpyrrolidin-3-yl)cyclopropane-1-carboxamide
CID 131018352
1-methyl-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)cycloheptane-1-carboxamide
CID 127795927
1-methyl-N-piperidin-3-ylcyclopropane-1-carboxamide
CID 126972708
N-[(1R,2R)-2-hydroxycyclohexyl]-1-methylcyclopentane-1-carboxamide
CID 104927764
N-(4-chlorocyclohexyl)-1-methylcyclohexane-1-carboxamide
CID 106828990
1-methyl-N-[(3S)-pyrrolidin-3-yl]cyclobutane-1-carboxamide
CID 166176322
(2S)-2-amino-N-(3-hydroxycyclobutyl)propanamide
CID 79026243

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxycyclobutyl)-1-methylcyclopropane-1-carboxamide?
The IUPAC name of N-(3-hydroxycyclobutyl)-1-methylcyclopropane-1-carboxamide (CID 126981151) is N-(3-hydroxycyclobutyl)-1-methylcyclopropane-1-carboxamide.
What is the SMILES notation for N-(3-hydroxycyclobutyl)-1-methylcyclopropane-1-carboxamide?
The canonical SMILES for N-(3-hydroxycyclobutyl)-1-methylcyclopropane-1-carboxamide is CC1(C(=O)NC2CC(O)C2)CC1.
What is the InChIKey of N-(3-hydroxycyclobutyl)-1-methylcyclopropane-1-carboxamide?
The InChIKey is CDJSSNSMMSDIPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO2/c1-9(2-3-9)8(12)10-6-4-7(11)5-6/h6-7,11H,2-5H2,1H3,(H,10,12).
What are the key properties of N-(3-hydroxycyclobutyl)-1-methylcyclopropane-1-carboxamide?
N-(3-hydroxycyclobutyl)-1-methylcyclopropane-1-carboxamide has a molecular weight of 169.22 g/mol, XLogP of 0.43, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxycyclobutyl)-1-methylcyclopropane-1-carboxamide is sourced from PubChem (CID 126981151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).