4-(cyclopentylmethyl)-2-(4-methoxyphenyl)piperidine-1-carboxamide

C19H28N2O2 — CID 70093736

IUPAC4-(cyclopentylmethyl)-2-(4-methoxyphenyl)piperidine-1-carboxamide
SMILESCOc1ccc(C2CC(CC3CCCC3)CCN2C(N)=O)cc1
InChIInChI=1S/C19H28N2O2/c1-23-17-8-6-16(7-9-17)18-13-15(10-11-21(18)19(20)22)12-14-4-2-3-5-14/h6-9,14-15,18H,2-5,10-13H2,1H3,(H2,20,22)
InChIKeyACVKKFGOLYJZMS-UHFFFAOYSA-N
MW316.44 g/mol
LogP4.11
Rot. Bonds4

About 4-(cyclopentylmethyl)-2-(4-methoxyphenyl)piperidine-1-carboxamide

4-(cyclopentylmethyl)-2-(4-methoxyphenyl)piperidine-1-carboxamide (PubChem CID 70093736) has the molecular formula C19H28N2O2 and a molecular weight of 316.44 g/mol. Its IUPAC name is 4-(cyclopentylmethyl)-2-(4-methoxyphenyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-(cyclopentylmethyl)-2-(4-methoxyphenyl)piperidine-1-carboxamide
PubChem CID70093736
Molecular FormulaC19H28N2O2
Molecular Weight316.44 g/mol
Exact Mass316.22
IUPAC Name4-(cyclopentylmethyl)-2-(4-methoxyphenyl)piperidine-1-carboxamide
SMILESCOc1ccc(C2CC(CC3CCCC3)CCN2C(N)=O)cc1
InChIInChI=1S/C19H28N2O2/c1-23-17-8-6-16(7-9-17)18-13-15(10-11-21(18)19(20)22)12-14-4-2-3-5-14/h6-9,14-15,18H,2-5,10-13H2,1H3,(H2,20,22)
InChIKeyACVKKFGOLYJZMS-UHFFFAOYSA-N
XLogP4.11
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.44
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(cyclopentylmethyl)-2-(4-methoxyphenyl)piperidine-1-carboxamide?
The IUPAC name of 4-(cyclopentylmethyl)-2-(4-methoxyphenyl)piperidine-1-carboxamide (CID 70093736) is 4-(cyclopentylmethyl)-2-(4-methoxyphenyl)piperidine-1-carboxamide.
What is the SMILES notation for 4-(cyclopentylmethyl)-2-(4-methoxyphenyl)piperidine-1-carboxamide?
The canonical SMILES for 4-(cyclopentylmethyl)-2-(4-methoxyphenyl)piperidine-1-carboxamide is COc1ccc(C2CC(CC3CCCC3)CCN2C(N)=O)cc1.
What is the InChIKey of 4-(cyclopentylmethyl)-2-(4-methoxyphenyl)piperidine-1-carboxamide?
The InChIKey is ACVKKFGOLYJZMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O2/c1-23-17-8-6-16(7-9-17)18-13-15(10-11-21(18)19(20)22)12-14-4-2-3-5-14/h6-9,14-15,18H,2-5,10-13H2,1H3,(H2,20,22).
What are the key properties of 4-(cyclopentylmethyl)-2-(4-methoxyphenyl)piperidine-1-carboxamide?
4-(cyclopentylmethyl)-2-(4-methoxyphenyl)piperidine-1-carboxamide has a molecular weight of 316.44 g/mol, XLogP of 4.11, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopentylmethyl)-2-(4-methoxyphenyl)piperidine-1-carboxamide is sourced from PubChem (CID 70093736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).