N-(1-cyclopropylpiperidin-4-yl)-2-methylbenzamide

C16H22N2O — CID 39974888

IUPACN-(1-cyclopropylpiperidin-4-yl)-2-methylbenzamide
SMILESCc1ccccc1C(=O)NC1CCN(C2CC2)CC1
InChIInChI=1S/C16H22N2O/c1-12-4-2-3-5-15(12)16(19)17-13-8-10-18(11-9-13)14-6-7-14/h2-5,13-14H,6-11H2,1H3,(H,17,19)
InChIKeyVEJNWFNHPUDWJT-UHFFFAOYSA-N
MW258.36 g/mol
LogP2.35
Rot. Bonds3

About N-(1-cyclopropylpiperidin-4-yl)-2-methylbenzamide

N-(1-cyclopropylpiperidin-4-yl)-2-methylbenzamide (PubChem CID 39974888) has the molecular formula C16H22N2O and a molecular weight of 258.36 g/mol. Its IUPAC name is N-(1-cyclopropylpiperidin-4-yl)-2-methylbenzamide.

Molecular Properties

Compound NameN-(1-cyclopropylpiperidin-4-yl)-2-methylbenzamide
PubChem CID39974888
Molecular FormulaC16H22N2O
Molecular Weight258.36 g/mol
Exact Mass258.17
IUPAC NameN-(1-cyclopropylpiperidin-4-yl)-2-methylbenzamide
SMILESCc1ccccc1C(=O)NC1CCN(C2CC2)CC1
InChIInChI=1S/C16H22N2O/c1-12-4-2-3-5-15(12)16(19)17-13-8-10-18(11-9-13)14-6-7-14/h2-5,13-14H,6-11H2,1H3,(H,17,19)
InChIKeyVEJNWFNHPUDWJT-UHFFFAOYSA-N
XLogP2.35
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopropyl-2-methylbenzamide;hydrochloride
CID 162767207
N,N-dimethyl-4-[(2-methylbenzoyl)amino]piperidine-1-carboxamide
CID 108562715
N-cyclopentyl-4-[(2-methylbenzoyl)amino]piperidine-1-carboxamide
CID 110822504
5-amino-N-(1-cyclopentylpiperidin-4-yl)-2-methylbenzamide
CID 120641743
2-methyl-N-[1-(2,2,2-trifluoroacetyl)piperidin-4-yl]benzamide
CID 108557648
N-[1-(1,1-dioxothian-4-yl)piperidin-4-yl]-2,5-dimethylbenzamide
CID 91761634
N-(4-aminocyclohexyl)-2-methylbenzamide
CID 43653114
N-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]-2-methylbenzamide
CID 136577669
4-[(2-methylbenzoyl)amino]cyclohexane-1-carboxylic acid
CID 60808371
2-chloro-N-(1-cyclopropylpiperidin-4-yl)pyridine-3-carboxamide
CID 60728134
2-methyl-N-[1-(4-phenylbenzoyl)piperidin-4-yl]benzamide
CID 39512672
N-[1-[[4-(hydroxymethyl)phenyl]methyl]piperidin-4-yl]-2-methylbenzamide
CID 110009371

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylpiperidin-4-yl)-2-methylbenzamide?
The IUPAC name of N-(1-cyclopropylpiperidin-4-yl)-2-methylbenzamide (CID 39974888) is N-(1-cyclopropylpiperidin-4-yl)-2-methylbenzamide.
What is the SMILES notation for N-(1-cyclopropylpiperidin-4-yl)-2-methylbenzamide?
The canonical SMILES for N-(1-cyclopropylpiperidin-4-yl)-2-methylbenzamide is Cc1ccccc1C(=O)NC1CCN(C2CC2)CC1.
What is the InChIKey of N-(1-cyclopropylpiperidin-4-yl)-2-methylbenzamide?
The InChIKey is VEJNWFNHPUDWJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O/c1-12-4-2-3-5-15(12)16(19)17-13-8-10-18(11-9-13)14-6-7-14/h2-5,13-14H,6-11H2,1H3,(H,17,19).
What are the key properties of N-(1-cyclopropylpiperidin-4-yl)-2-methylbenzamide?
N-(1-cyclopropylpiperidin-4-yl)-2-methylbenzamide has a molecular weight of 258.36 g/mol, XLogP of 2.35, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylpiperidin-4-yl)-2-methylbenzamide is sourced from PubChem (CID 39974888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).