2-[4-(cyclopropanecarbonylamino)piperidin-1-yl]-N-(cyclopropylmethyl)benzamide

C20H27N3O2 — CID 42848145

IUPAC2-[4-(cyclopropanecarbonylamino)piperidin-1-yl]-N-(cyclopropylmethyl)benzamide
SMILESO=C(NCC1CC1)c1ccccc1N1CCC(NC(=O)C2CC2)CC1
InChIInChI=1S/C20H27N3O2/c24-19(15-7-8-15)22-16-9-11-23(12-10-16)18-4-2-1-3-17(18)20(25)21-13-14-5-6-14/h1-4,14-16H,5-13H2,(H,21,25)(H,22,24)
InChIKeyPCPOLNCIVOKCKH-UHFFFAOYSA-N
MW341.45 g/mol
LogP2.32
Rot. Bonds6

About 2-[4-(cyclopropanecarbonylamino)piperidin-1-yl]-N-(cyclopropylmethyl)benzamide

2-[4-(cyclopropanecarbonylamino)piperidin-1-yl]-N-(cyclopropylmethyl)benzamide (PubChem CID 42848145) has the molecular formula C20H27N3O2 and a molecular weight of 341.45 g/mol. Its IUPAC name is 2-[4-(cyclopropanecarbonylamino)piperidin-1-yl]-N-(cyclopropylmethyl)benzamide.

Molecular Properties

Compound Name2-[4-(cyclopropanecarbonylamino)piperidin-1-yl]-N-(cyclopropylmethyl)benzamide
PubChem CID42848145
Molecular FormulaC20H27N3O2
Molecular Weight341.45 g/mol
Exact Mass341.21
IUPAC Name2-[4-(cyclopropanecarbonylamino)piperidin-1-yl]-N-(cyclopropylmethyl)benzamide
SMILESO=C(NCC1CC1)c1ccccc1N1CCC(NC(=O)C2CC2)CC1
InChIInChI=1S/C20H27N3O2/c24-19(15-7-8-15)22-16-9-11-23(12-10-16)18-4-2-1-3-17(18)20(25)21-13-14-5-6-14/h1-4,14-16H,5-13H2,(H,21,25)(H,22,24)
InChIKeyPCPOLNCIVOKCKH-UHFFFAOYSA-N
XLogP2.32
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.45
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclohexylmethyl)-2-[4-(2-methylpropanoylamino)piperidin-1-yl]benzamide
CID 42848215
2-[4-(cyclobutanecarbonylamino)piperidin-1-yl]-N-(2-pyrrolidin-1-ylethyl)benzamide
CID 42847952
2,4-dichloro-N-[1-[2-(cyclopropylmethylcarbamoyl)phenyl]piperidin-4-yl]benzamide
CID 42848150
2-[4-(cyclopropanecarbonylamino)piperidin-1-yl]-N-(pyridin-3-ylmethyl)benzamide
CID 24719003
2-[4-(cyclopentanecarbonylamino)piperidin-1-yl]-N-[2-(2-methoxyphenyl)ethyl]benzamide
CID 46037903
2-[4-(cyclopentanecarbonylamino)piperidin-1-yl]-N-(furan-2-ylmethyl)benzamide
CID 42847997
N-(cyclohexylmethyl)-2-[4-[[(2S)-2-phenylbutanoyl]amino]piperidin-1-yl]benzamide
CID 93324127
N-[1-[2-[4-(2-ethoxyphenyl)piperazine-1-carbonyl]phenyl]piperidin-4-yl]cyclopropanecarboxamide
CID 24719026
2-(4-aminopiperidin-1-yl)-N-cyclopropylbenzamide
CID 42656462
2-(4-acetamidopiperidin-1-yl)-N-(oxolan-2-ylmethyl)benzamide
CID 46037624
2-(4-benzamidopiperidin-1-yl)-N-(2-phenylethyl)benzamide
CID 46037520
2-[4-[(2-chlorobenzoyl)amino]piperidin-1-yl]-N-[2-(2-methoxyphenyl)ethyl]benzamide
CID 46037896

Frequently Asked Questions

What is the IUPAC name of 2-[4-(cyclopropanecarbonylamino)piperidin-1-yl]-N-(cyclopropylmethyl)benzamide?
The IUPAC name of 2-[4-(cyclopropanecarbonylamino)piperidin-1-yl]-N-(cyclopropylmethyl)benzamide (CID 42848145) is 2-[4-(cyclopropanecarbonylamino)piperidin-1-yl]-N-(cyclopropylmethyl)benzamide.
What is the SMILES notation for 2-[4-(cyclopropanecarbonylamino)piperidin-1-yl]-N-(cyclopropylmethyl)benzamide?
The canonical SMILES for 2-[4-(cyclopropanecarbonylamino)piperidin-1-yl]-N-(cyclopropylmethyl)benzamide is O=C(NCC1CC1)c1ccccc1N1CCC(NC(=O)C2CC2)CC1.
What is the InChIKey of 2-[4-(cyclopropanecarbonylamino)piperidin-1-yl]-N-(cyclopropylmethyl)benzamide?
The InChIKey is PCPOLNCIVOKCKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O2/c24-19(15-7-8-15)22-16-9-11-23(12-10-16)18-4-2-1-3-17(18)20(25)21-13-14-5-6-14/h1-4,14-16H,5-13H2,(H,21,25)(H,22,24).
What are the key properties of 2-[4-(cyclopropanecarbonylamino)piperidin-1-yl]-N-(cyclopropylmethyl)benzamide?
2-[4-(cyclopropanecarbonylamino)piperidin-1-yl]-N-(cyclopropylmethyl)benzamide has a molecular weight of 341.45 g/mol, XLogP of 2.32, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(cyclopropanecarbonylamino)piperidin-1-yl]-N-(cyclopropylmethyl)benzamide is sourced from PubChem (CID 42848145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).