1-[2-(4-methoxyphenyl)-4-pyridinyl]piperidine-4-carboxamide

C18H21N3O2 — CID 67218664

IUPAC1-[2-(4-methoxyphenyl)-4-pyridinyl]piperidine-4-carboxamide
SMILESCOc1ccc(-c2cc(N3CCC(C(N)=O)CC3)ccn2)cc1
InChIInChI=1S/C18H21N3O2/c1-23-16-4-2-13(3-5-16)17-12-15(6-9-20-17)21-10-7-14(8-11-21)18(19)22/h2-6,9,12,14H,7-8,10-11H2,1H3,(H2,19,22)
InChIKeyMVZPLGXAPMGVRN-UHFFFAOYSA-N
MW311.39 g/mol
LogP2.46
Rot. Bonds4

About 1-[2-(4-methoxyphenyl)-4-pyridinyl]piperidine-4-carboxamide

1-[2-(4-methoxyphenyl)-4-pyridinyl]piperidine-4-carboxamide (PubChem CID 67218664) has the molecular formula C18H21N3O2 and a molecular weight of 311.39 g/mol. Its IUPAC name is 1-[2-(4-methoxyphenyl)-4-pyridinyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[2-(4-methoxyphenyl)-4-pyridinyl]piperidine-4-carboxamide
PubChem CID67218664
Molecular FormulaC18H21N3O2
Molecular Weight311.39 g/mol
Exact Mass311.16
IUPAC Name1-[2-(4-methoxyphenyl)-4-pyridinyl]piperidine-4-carboxamide
SMILESCOc1ccc(-c2cc(N3CCC(C(N)=O)CC3)ccn2)cc1
InChIInChI=1S/C18H21N3O2/c1-23-16-4-2-13(3-5-16)17-12-15(6-9-20-17)21-10-7-14(8-11-21)18(19)22/h2-6,9,12,14H,7-8,10-11H2,1H3,(H2,19,22)
InChIKeyMVZPLGXAPMGVRN-UHFFFAOYSA-N
XLogP2.46
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.39
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(6-methoxyquinazolin-4-yl)piperidine-4-carboxamide
CID 21002803
1-(5-methoxypyrimidin-2-yl)piperidine-4-carboxamide
CID 154883318
[1-[6-(4-methoxyphenyl)pyrimidin-4-yl]piperidin-4-yl]-(4-phenylpiperazin-1-yl)methanone
CID 90519445
[4-(3-chlorophenyl)piperazin-1-yl]-[1-[6-(4-methoxyphenyl)pyrimidin-4-yl]piperidin-4-yl]methanone
CID 90519448
1-(2-carbamoyl-4-pyridinyl)piperidine-4-carboxylic acid
CID 43517519
1-[4-[2-[4-(trifluoromethoxy)phenyl]-4-pyridinyl]piperazin-1-yl]ethanone
CID 139573877
1-[5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-4-yl]piperidine-4-carboxamide
CID 2457611
N-cyclopentyl-1-[6-(4-methoxyphenyl)pyridazin-3-yl]piperidine-4-carboxamide
CID 30361225
4-[4-(3-methoxyphenyl)piperazin-1-yl]pyridine-2-carboxamide
CID 133313294
1-(2-carbamothioyl-5-methoxyphenyl)piperidine-4-carboxamide
CID 81306580
[4-[4-(4-methoxyphenyl)piperazin-1-yl]-2-pyridinyl]-pyrrolidin-1-ylmethanone
CID 109203696
4-[[1-(4-methoxyphenyl)piperidin-4-yl]amino]pyridine-2-carboxamide
CID 133314091

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-methoxyphenyl)-4-pyridinyl]piperidine-4-carboxamide?
The IUPAC name of 1-[2-(4-methoxyphenyl)-4-pyridinyl]piperidine-4-carboxamide (CID 67218664) is 1-[2-(4-methoxyphenyl)-4-pyridinyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-[2-(4-methoxyphenyl)-4-pyridinyl]piperidine-4-carboxamide?
The canonical SMILES for 1-[2-(4-methoxyphenyl)-4-pyridinyl]piperidine-4-carboxamide is COc1ccc(-c2cc(N3CCC(C(N)=O)CC3)ccn2)cc1.
What is the InChIKey of 1-[2-(4-methoxyphenyl)-4-pyridinyl]piperidine-4-carboxamide?
The InChIKey is MVZPLGXAPMGVRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O2/c1-23-16-4-2-13(3-5-16)17-12-15(6-9-20-17)21-10-7-14(8-11-21)18(19)22/h2-6,9,12,14H,7-8,10-11H2,1H3,(H2,19,22).
What are the key properties of 1-[2-(4-methoxyphenyl)-4-pyridinyl]piperidine-4-carboxamide?
1-[2-(4-methoxyphenyl)-4-pyridinyl]piperidine-4-carboxamide has a molecular weight of 311.39 g/mol, XLogP of 2.46, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-methoxyphenyl)-4-pyridinyl]piperidine-4-carboxamide is sourced from PubChem (CID 67218664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).