N-cyclopropyl-2-[4-(2-methylpropanoylamino)piperidin-1-yl]benzamide

C19H27N3O2 — CID 42848047

IUPACN-cyclopropyl-2-[4-(2-methylpropanoylamino)piperidin-1-yl]benzamide
SMILESCC(C)C(=O)NC1CCN(c2ccccc2C(=O)NC2CC2)CC1
InChIInChI=1S/C19H27N3O2/c1-13(2)18(23)20-15-9-11-22(12-10-15)17-6-4-3-5-16(17)19(24)21-14-7-8-14/h3-6,13-15H,7-12H2,1-2H3,(H,20,23)(H,21,24)
InChIKeyYMGFMZCVONGSQA-UHFFFAOYSA-N
MW329.44 g/mol
LogP2.32
Rot. Bonds5

About N-cyclopropyl-2-[4-(2-methylpropanoylamino)piperidin-1-yl]benzamide

N-cyclopropyl-2-[4-(2-methylpropanoylamino)piperidin-1-yl]benzamide (PubChem CID 42848047) has the molecular formula C19H27N3O2 and a molecular weight of 329.44 g/mol. Its IUPAC name is N-cyclopropyl-2-[4-(2-methylpropanoylamino)piperidin-1-yl]benzamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[4-(2-methylpropanoylamino)piperidin-1-yl]benzamide
PubChem CID42848047
Molecular FormulaC19H27N3O2
Molecular Weight329.44 g/mol
Exact Mass329.21
IUPAC NameN-cyclopropyl-2-[4-(2-methylpropanoylamino)piperidin-1-yl]benzamide
SMILESCC(C)C(=O)NC1CCN(c2ccccc2C(=O)NC2CC2)CC1
InChIInChI=1S/C19H27N3O2/c1-13(2)18(23)20-15-9-11-22(12-10-15)17-6-4-3-5-16(17)19(24)21-14-7-8-14/h3-6,13-15H,7-12H2,1-2H3,(H,20,23)(H,21,24)
InChIKeyYMGFMZCVONGSQA-UHFFFAOYSA-N
XLogP2.32
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.44
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-butan-2-yl-2-[4-(2-methylpropanoylamino)piperidin-1-yl]benzamide
CID 42848022
N-(cyclohexylmethyl)-2-[4-(2-methylpropanoylamino)piperidin-1-yl]benzamide
CID 42848215
2-(4-aminopiperidin-1-yl)-N-cyclopropylbenzamide
CID 42656462
N-[2-(2-methoxyphenyl)ethyl]-2-[4-(2-methylpropanoylamino)piperidin-1-yl]benzamide
CID 46037893
N-[1-[2-(cyclopropylcarbamoyl)phenyl]piperidin-4-yl]thiophene-2-carboxamide
CID 46156012
2-[4-[(2-chlorobenzoyl)amino]piperidin-1-yl]-N-[(2R)-3-methylbutan-2-yl]benzamide
CID 93324123
2-methyl-N-[1-[2-(3-methylbutan-2-ylcarbamoyl)phenyl]piperidin-4-yl]benzamide
CID 46037808
N-cyclohexyl-2-pyrrolidin-1-ylbenzamide
CID 168514596
N-cyclopropyl-2-[4-[(2-thiophen-2-ylacetyl)amino]piperidin-1-yl]benzamide
CID 46156025
2-(4-benzamidopiperidin-1-yl)-N-[(1R)-1-phenylethyl]benzamide
CID 93290973
2-(4-benzamidopiperidin-1-yl)-N-butan-2-ylbenzamide
CID 46037432
2-methyl-N-[1-[2-[[(2R)-2-methylbutyl]carbamoyl]phenyl]piperidin-4-yl]benzamide
CID 93291034

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[4-(2-methylpropanoylamino)piperidin-1-yl]benzamide?
The IUPAC name of N-cyclopropyl-2-[4-(2-methylpropanoylamino)piperidin-1-yl]benzamide (CID 42848047) is N-cyclopropyl-2-[4-(2-methylpropanoylamino)piperidin-1-yl]benzamide.
What is the SMILES notation for N-cyclopropyl-2-[4-(2-methylpropanoylamino)piperidin-1-yl]benzamide?
The canonical SMILES for N-cyclopropyl-2-[4-(2-methylpropanoylamino)piperidin-1-yl]benzamide is CC(C)C(=O)NC1CCN(c2ccccc2C(=O)NC2CC2)CC1.
What is the InChIKey of N-cyclopropyl-2-[4-(2-methylpropanoylamino)piperidin-1-yl]benzamide?
The InChIKey is YMGFMZCVONGSQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N3O2/c1-13(2)18(23)20-15-9-11-22(12-10-15)17-6-4-3-5-16(17)19(24)21-14-7-8-14/h3-6,13-15H,7-12H2,1-2H3,(H,20,23)(H,21,24).
What are the key properties of N-cyclopropyl-2-[4-(2-methylpropanoylamino)piperidin-1-yl]benzamide?
N-cyclopropyl-2-[4-(2-methylpropanoylamino)piperidin-1-yl]benzamide has a molecular weight of 329.44 g/mol, XLogP of 2.32, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[4-(2-methylpropanoylamino)piperidin-1-yl]benzamide is sourced from PubChem (CID 42848047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).