N-[1-(azetidin-3-yl)ethyl]-1-methylcyclopropane-1-carboxamide

C10H18N2O — CID 165475673

IUPACN-[1-(azetidin-3-yl)ethyl]-1-methylcyclopropane-1-carboxamide
SMILESCC(NC(=O)C1(C)CC1)C1CNC1
InChIInChI=1S/C10H18N2O/c1-7(8-5-11-6-8)12-9(13)10(2)3-4-10/h7-8,11H,3-6H2,1-2H3,(H,12,13)
InChIKeyRLJUTGMYLKEVGK-UHFFFAOYSA-N
MW182.27 g/mol
LogP0.51
Rot. Bonds3

About N-[1-(azetidin-3-yl)ethyl]-1-methylcyclopropane-1-carboxamide

N-[1-(azetidin-3-yl)ethyl]-1-methylcyclopropane-1-carboxamide (PubChem CID 165475673) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is N-[1-(azetidin-3-yl)ethyl]-1-methylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-[1-(azetidin-3-yl)ethyl]-1-methylcyclopropane-1-carboxamide
PubChem CID165475673
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC NameN-[1-(azetidin-3-yl)ethyl]-1-methylcyclopropane-1-carboxamide
SMILESCC(NC(=O)C1(C)CC1)C1CNC1
InChIInChI=1S/C10H18N2O/c1-7(8-5-11-6-8)12-9(13)10(2)3-4-10/h7-8,11H,3-6H2,1-2H3,(H,12,13)
InChIKeyRLJUTGMYLKEVGK-UHFFFAOYSA-N
XLogP0.51
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1R)-1-cyclopentylethyl]-3-methylpyrrolidine-3-carboxamide
CID 81388379
N-[(1R)-1-cycloheptylethyl]-3-methylpiperidine-3-carboxamide
CID 81392969
(1R,5S)-N-[(1R)-1-cyclohexylethyl]-1,5,7-trimethyl-2,4-dioxo-3-azabicyclo[3.3.1]nonane-7-carboxamide
CID 10871765
N-but-3-yn-2-yl-4-methylpiperidine-4-carboxamide
CID 114417108
1-phenyl-N-(1-piperidin-3-ylethyl)cyclopropane-1-carboxamide
CID 62880723
N-[(1S)-1-cyclopentylethyl]-4-ethylpiperidine-4-carboxamide
CID 81390475
N-[(1R)-1-cycloheptylethyl]-2-methylpiperidine-2-carboxamide
CID 104597083
4-methyl-N-(6-methylheptan-2-yl)piperidine-4-carboxamide
CID 63122377
N-[(1R)-1-cyclohexylethyl]-4-ethylpiperidine-4-carboxamide
CID 81385512
N-[(1S)-1-[(1R,2R,4R)-2-bicyclo[2.2.1]heptanyl]ethyl]-1-methylcyclohexane-1-carboxamide
CID 98126823
N-[(1R)-1-[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-1-methylcyclohexane-1-carboxamide
CID 98219100
N-(1-cyclopropylethyl)-4-pyrazol-1-ylpiperidine-4-carboxamide
CID 120919574

Frequently Asked Questions

What is the IUPAC name of N-[1-(azetidin-3-yl)ethyl]-1-methylcyclopropane-1-carboxamide?
The IUPAC name of N-[1-(azetidin-3-yl)ethyl]-1-methylcyclopropane-1-carboxamide (CID 165475673) is N-[1-(azetidin-3-yl)ethyl]-1-methylcyclopropane-1-carboxamide.
What is the SMILES notation for N-[1-(azetidin-3-yl)ethyl]-1-methylcyclopropane-1-carboxamide?
The canonical SMILES for N-[1-(azetidin-3-yl)ethyl]-1-methylcyclopropane-1-carboxamide is CC(NC(=O)C1(C)CC1)C1CNC1.
What is the InChIKey of N-[1-(azetidin-3-yl)ethyl]-1-methylcyclopropane-1-carboxamide?
The InChIKey is RLJUTGMYLKEVGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c1-7(8-5-11-6-8)12-9(13)10(2)3-4-10/h7-8,11H,3-6H2,1-2H3,(H,12,13).
What are the key properties of N-[1-(azetidin-3-yl)ethyl]-1-methylcyclopropane-1-carboxamide?
N-[1-(azetidin-3-yl)ethyl]-1-methylcyclopropane-1-carboxamide has a molecular weight of 182.27 g/mol, XLogP of 0.51, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(azetidin-3-yl)ethyl]-1-methylcyclopropane-1-carboxamide is sourced from PubChem (CID 165475673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).