2-(azetidin-3-yl)-N-methyl-N-(4-methylcyclohexyl)propanamide

C14H26N2O — CID 116676307

IUPAC2-(azetidin-3-yl)-N-methyl-N-(4-methylcyclohexyl)propanamide
SMILESCC1CCC(N(C)C(=O)C(C)C2CNC2)CC1
InChIInChI=1S/C14H26N2O/c1-10-4-6-13(7-5-10)16(3)14(17)11(2)12-8-15-9-12/h10-13,15H,4-9H2,1-3H3
InChIKeyHNRQXJGCLSRBIP-UHFFFAOYSA-N
MW238.37 g/mol
LogP1.88
Rot. Bonds3

About 2-(azetidin-3-yl)-N-methyl-N-(4-methylcyclohexyl)propanamide

2-(azetidin-3-yl)-N-methyl-N-(4-methylcyclohexyl)propanamide (PubChem CID 116676307) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 2-(azetidin-3-yl)-N-methyl-N-(4-methylcyclohexyl)propanamide.

Molecular Properties

Compound Name2-(azetidin-3-yl)-N-methyl-N-(4-methylcyclohexyl)propanamide
PubChem CID116676307
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name2-(azetidin-3-yl)-N-methyl-N-(4-methylcyclohexyl)propanamide
SMILESCC1CCC(N(C)C(=O)C(C)C2CNC2)CC1
InChIInChI=1S/C14H26N2O/c1-10-4-6-13(7-5-10)16(3)14(17)11(2)12-8-15-9-12/h10-13,15H,4-9H2,1-3H3
InChIKeyHNRQXJGCLSRBIP-UHFFFAOYSA-N
XLogP1.88
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Butyramide, N-(4-butylcyclohexyl)-
CID 58003
4-[[(2S)-1-cyclohexylpropan-2-yl]amino]-N,N-dimethylbutanamide
CID 95209022
4-(methylamino)-N-[4-(trifluoromethyl)cyclohexyl]butanamide
CID 60841900
4-(propan-2-ylamino)-N-[4-(trifluoromethyl)cyclohexyl]butanamide
CID 60850841
2-(azetidin-3-yl)-N-[4-(trifluoromethyl)cyclohexyl]acetamide
CID 64617204
2-(azetidin-3-yl)-N-[2-(trifluoromethyl)cyclohexyl]acetamide
CID 64617385
2-(azetidin-3-yl)-N-[3-(trifluoromethyl)cyclohexyl]acetamide
CID 64618767
4-amino-2-methyl-N-[4-(trifluoromethyl)cyclohexyl]butanamide
CID 80542836
4-amino-3-methyl-N-[4-(trifluoromethyl)cyclohexyl]butanamide
CID 81075884
2-(azetidin-3-yl)-N-[3-(trifluoromethyl)cyclohexyl]propanamide
CID 116675743
2-(azetidin-3-yl)-N-[4-(trifluoromethyl)cyclohexyl]propanamide
CID 116675798
2-(azetidin-3-yl)-N-[2-(trifluoromethyl)cyclohexyl]propanamide
CID 116675802

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-3-yl)-N-methyl-N-(4-methylcyclohexyl)propanamide?
The IUPAC name of 2-(azetidin-3-yl)-N-methyl-N-(4-methylcyclohexyl)propanamide (CID 116676307) is 2-(azetidin-3-yl)-N-methyl-N-(4-methylcyclohexyl)propanamide.
What is the SMILES notation for 2-(azetidin-3-yl)-N-methyl-N-(4-methylcyclohexyl)propanamide?
The canonical SMILES for 2-(azetidin-3-yl)-N-methyl-N-(4-methylcyclohexyl)propanamide is CC1CCC(N(C)C(=O)C(C)C2CNC2)CC1.
What is the InChIKey of 2-(azetidin-3-yl)-N-methyl-N-(4-methylcyclohexyl)propanamide?
The InChIKey is HNRQXJGCLSRBIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-10-4-6-13(7-5-10)16(3)14(17)11(2)12-8-15-9-12/h10-13,15H,4-9H2,1-3H3.
What are the key properties of 2-(azetidin-3-yl)-N-methyl-N-(4-methylcyclohexyl)propanamide?
2-(azetidin-3-yl)-N-methyl-N-(4-methylcyclohexyl)propanamide has a molecular weight of 238.37 g/mol, XLogP of 1.88, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-3-yl)-N-methyl-N-(4-methylcyclohexyl)propanamide is sourced from PubChem (CID 116676307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).