N-(4-methyl-3-piperidin-4-ylphenyl)cyclopropanecarboxamide

C16H22N2O — CID 86235737

IUPACN-(4-methyl-3-piperidin-4-ylphenyl)cyclopropanecarboxamide
SMILESCc1ccc(NC(=O)C2CC2)cc1C1CCNCC1
InChIInChI=1S/C16H22N2O/c1-11-2-5-14(18-16(19)13-3-4-13)10-15(11)12-6-8-17-9-7-12/h2,5,10,12-13,17H,3-4,6-9H2,1H3,(H,18,19)
InChIKeyUSXWNDRTZTXEFW-UHFFFAOYSA-N
MW258.36 g/mol
LogP2.81
Rot. Bonds3

About N-(4-methyl-3-piperidin-4-ylphenyl)cyclopropanecarboxamide

N-(4-methyl-3-piperidin-4-ylphenyl)cyclopropanecarboxamide (PubChem CID 86235737) has the molecular formula C16H22N2O and a molecular weight of 258.36 g/mol. Its IUPAC name is N-(4-methyl-3-piperidin-4-ylphenyl)cyclopropanecarboxamide.

Molecular Properties

Compound NameN-(4-methyl-3-piperidin-4-ylphenyl)cyclopropanecarboxamide
PubChem CID86235737
Molecular FormulaC16H22N2O
Molecular Weight258.36 g/mol
Exact Mass258.17
IUPAC NameN-(4-methyl-3-piperidin-4-ylphenyl)cyclopropanecarboxamide
SMILESCc1ccc(NC(=O)C2CC2)cc1C1CCNCC1
InChIInChI=1S/C16H22N2O/c1-11-2-5-14(18-16(19)13-3-4-13)10-15(11)12-6-8-17-9-7-12/h2,5,10,12-13,17H,3-4,6-9H2,1H3,(H,18,19)
InChIKeyUSXWNDRTZTXEFW-UHFFFAOYSA-N
XLogP2.81
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-(2,2-dimethylpropanoylamino)-4-methylphenyl]piperidine-4-carboxamide
CID 119321965
N-[4-(propanoylamino)phenyl]piperidine-4-carboxamide
CID 43708676
N-[5-(2,2-dimethylpropanoylamino)-2-methylphenyl]piperidine-4-carboxamide
CID 119321946
sodium;acetic acid;hydride;N-(4-piperidin-4-ylphenyl)piperidine-4-carboxamide
CID 173252213
N-(3-methyl-4-propan-2-yloxyphenyl)piperidine-4-carboxamide
CID 98034216
N-[3-(2,2-difluoroethoxy)-4-methylphenyl]piperidine-4-carboxamide
CID 119314646
N-(2,5-dimethylphenyl)piperidine-4-carboxamide
CID 18073176
N-[3-(propanoylamino)phenyl]piperidine-4-carboxamide
CID 54794417
N-[4-(2-methylpropanoylamino)phenyl]piperidine-4-carboxamide;hydrochloride
CID 119268961
methyl 4-(piperidine-4-carbonylamino)benzoate
CID 61258374
(E)-3-[4-(cyclopropanecarbonylamino)-2-methylphenyl]prop-2-enoic acid
CID 94230826
N-[1-[4-(cyclopropanecarbonylamino)phenyl]ethyl]piperidine-4-carboxamide;hydrochloride
CID 119288587

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-3-piperidin-4-ylphenyl)cyclopropanecarboxamide?
The IUPAC name of N-(4-methyl-3-piperidin-4-ylphenyl)cyclopropanecarboxamide (CID 86235737) is N-(4-methyl-3-piperidin-4-ylphenyl)cyclopropanecarboxamide.
What is the SMILES notation for N-(4-methyl-3-piperidin-4-ylphenyl)cyclopropanecarboxamide?
The canonical SMILES for N-(4-methyl-3-piperidin-4-ylphenyl)cyclopropanecarboxamide is Cc1ccc(NC(=O)C2CC2)cc1C1CCNCC1.
What is the InChIKey of N-(4-methyl-3-piperidin-4-ylphenyl)cyclopropanecarboxamide?
The InChIKey is USXWNDRTZTXEFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O/c1-11-2-5-14(18-16(19)13-3-4-13)10-15(11)12-6-8-17-9-7-12/h2,5,10,12-13,17H,3-4,6-9H2,1H3,(H,18,19).
What are the key properties of N-(4-methyl-3-piperidin-4-ylphenyl)cyclopropanecarboxamide?
N-(4-methyl-3-piperidin-4-ylphenyl)cyclopropanecarboxamide has a molecular weight of 258.36 g/mol, XLogP of 2.81, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-3-piperidin-4-ylphenyl)cyclopropanecarboxamide is sourced from PubChem (CID 86235737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).