N-methyl-N-phenyl-1-(piperidine-1-carbonyl)cyclopropane-1-carboxamide

C17H22N2O2 — CID 108972027

IUPACN-methyl-N-phenyl-1-(piperidine-1-carbonyl)cyclopropane-1-carboxamide
SMILESCN(C(=O)C1(C(=O)N2CCCCC2)CC1)c1ccccc1
InChIInChI=1S/C17H22N2O2/c1-18(14-8-4-2-5-9-14)15(20)17(10-11-17)16(21)19-12-6-3-7-13-19/h2,4-5,8-9H,3,6-7,10-13H2,1H3
InChIKeyINXFVCOUHBGSED-UHFFFAOYSA-N
MW286.37 g/mol
LogP2.44
Rot. Bonds3

About N-methyl-N-phenyl-1-(piperidine-1-carbonyl)cyclopropane-1-carboxamide

N-methyl-N-phenyl-1-(piperidine-1-carbonyl)cyclopropane-1-carboxamide (PubChem CID 108972027) has the molecular formula C17H22N2O2 and a molecular weight of 286.37 g/mol. Its IUPAC name is N-methyl-N-phenyl-1-(piperidine-1-carbonyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-methyl-N-phenyl-1-(piperidine-1-carbonyl)cyclopropane-1-carboxamide
PubChem CID108972027
Molecular FormulaC17H22N2O2
Molecular Weight286.37 g/mol
Exact Mass286.17
IUPAC NameN-methyl-N-phenyl-1-(piperidine-1-carbonyl)cyclopropane-1-carboxamide
SMILESCN(C(=O)C1(C(=O)N2CCCCC2)CC1)c1ccccc1
InChIInChI=1S/C17H22N2O2/c1-18(14-8-4-2-5-9-14)15(20)17(10-11-17)16(21)19-12-6-3-7-13-19/h2,4-5,8-9H,3,6-7,10-13H2,1H3
InChIKeyINXFVCOUHBGSED-UHFFFAOYSA-N
XLogP2.44
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.37
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Related Compounds

N-methyl-N-phenylpiperidine-1-carboxamide
CID 54133936
N-benzyl-1-(piperidine-1-carbonyl)-N-propan-2-ylcyclopropane-1-carboxamide
CID 108972011
N-ethyl-N-(3-methylphenyl)-1-(piperidine-1-carbonyl)cyclopropane-1-carboxamide
CID 108972125
1-N'-methyl-1-N'-phenyl-1-N-(4-pyrrolidin-1-ylphenyl)cyclopropane-1,1-dicarboxamide
CID 108981003
N-ethyl-1-(4-methylpiperazine-1-carbonyl)-N-phenylcyclopropane-1-carboxamide
CID 108973986
1-(azepane-1-carbonyl)-N-(1-phenylethyl)cyclopropane-1-carboxamide
CID 108975396
1-amino-N-methyl-N-phenylcyclopentane-1-carboxamide;hydrochloride
CID 119261831
N-benzyl-1-(piperidine-1-carbonyl)cyclopropane-1-carboxamide
CID 108971956
N-methyl-6-oxo-N-phenyl-6-piperidin-1-ylhexanamide
CID 10733166
1-[methyl(phenyl)carbamoyl]piperidine-4-carboxylic acid
CID 28513181
[1-(4-benzylpiperidine-1-carbonyl)cyclopropyl]-piperidin-1-ylmethanone
CID 108972015
azepan-1-yl-[1-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]cyclopropyl]methanone
CID 108978812

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-phenyl-1-(piperidine-1-carbonyl)cyclopropane-1-carboxamide?
The IUPAC name of N-methyl-N-phenyl-1-(piperidine-1-carbonyl)cyclopropane-1-carboxamide (CID 108972027) is N-methyl-N-phenyl-1-(piperidine-1-carbonyl)cyclopropane-1-carboxamide.
What is the SMILES notation for N-methyl-N-phenyl-1-(piperidine-1-carbonyl)cyclopropane-1-carboxamide?
The canonical SMILES for N-methyl-N-phenyl-1-(piperidine-1-carbonyl)cyclopropane-1-carboxamide is CN(C(=O)C1(C(=O)N2CCCCC2)CC1)c1ccccc1.
What is the InChIKey of N-methyl-N-phenyl-1-(piperidine-1-carbonyl)cyclopropane-1-carboxamide?
The InChIKey is INXFVCOUHBGSED-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2/c1-18(14-8-4-2-5-9-14)15(20)17(10-11-17)16(21)19-12-6-3-7-13-19/h2,4-5,8-9H,3,6-7,10-13H2,1H3.
What are the key properties of N-methyl-N-phenyl-1-(piperidine-1-carbonyl)cyclopropane-1-carboxamide?
N-methyl-N-phenyl-1-(piperidine-1-carbonyl)cyclopropane-1-carboxamide has a molecular weight of 286.37 g/mol, XLogP of 2.44, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-phenyl-1-(piperidine-1-carbonyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 108972027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).