1-(naphthalene-1-carbonyl)-N-pyridin-4-ylpiperidine-4-carboxamide

C22H21N3O2 — CID 27700417

IUPAC1-(naphthalene-1-carbonyl)-N-pyridin-4-ylpiperidine-4-carboxamide
SMILESO=C(Nc1ccncc1)C1CCN(C(=O)c2cccc3ccccc23)CC1
InChIInChI=1S/C22H21N3O2/c26-21(24-18-8-12-23-13-9-18)17-10-14-25(15-11-17)22(27)20-7-3-5-16-4-1-2-6-19(16)20/h1-9,12-13,17H,10-11,14-15H2,(H,23,24,26)
InChIKeyUIWVGGIOEKBLOM-UHFFFAOYSA-N
MW359.43 g/mol
LogP3.73
Rot. Bonds3

About 1-(naphthalene-1-carbonyl)-N-pyridin-4-ylpiperidine-4-carboxamide

1-(naphthalene-1-carbonyl)-N-pyridin-4-ylpiperidine-4-carboxamide (PubChem CID 27700417) has the molecular formula C22H21N3O2 and a molecular weight of 359.43 g/mol. Its IUPAC name is 1-(naphthalene-1-carbonyl)-N-pyridin-4-ylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-(naphthalene-1-carbonyl)-N-pyridin-4-ylpiperidine-4-carboxamide
PubChem CID27700417
Molecular FormulaC22H21N3O2
Molecular Weight359.43 g/mol
Exact Mass359.16
IUPAC Name1-(naphthalene-1-carbonyl)-N-pyridin-4-ylpiperidine-4-carboxamide
SMILESO=C(Nc1ccncc1)C1CCN(C(=O)c2cccc3ccccc23)CC1
InChIInChI=1S/C22H21N3O2/c26-21(24-18-8-12-23-13-9-18)17-10-14-25(15-11-17)22(27)20-7-3-5-16-4-1-2-6-19(16)20/h1-9,12-13,17H,10-11,14-15H2,(H,23,24,26)
InChIKeyUIWVGGIOEKBLOM-UHFFFAOYSA-N
XLogP3.73
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.43
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[[1-(naphthalene-1-carbonyl)piperidine-4-carbonyl]amino]phenyl]pyridine-4-carboxamide
CID 55610513
1-(naphthalene-1-carbonyl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide
CID 17465771
N-[4-(diethylamino)phenyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 46581827
1-(naphthalene-1-carbonyl)-N-(1,3-thiazol-2-yl)piperidine-4-carboxamide
CID 17447647
1-(naphthalene-1-carbonyl)-N-(3-sulfamoylphenyl)piperidine-4-carboxamide
CID 27396106
N-[1-[4-(cyclopropanecarbonylamino)phenyl]ethyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 46580851
N-(2-fluorophenyl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 27396109
N-(3-chloro-4-piperidin-1-ylphenyl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 55884883
1-(naphthalene-1-carbonyl)-N-[4-(2,2,2-trifluoroethylcarbamoyl)phenyl]piperidine-4-carboxamide
CID 112815469
1-(naphthalene-1-carbonyl)-N-[1-(phenylcarbamoyl)piperidin-4-yl]piperidine-4-carboxamide
CID 134042483
methyl 2-[[1-(naphthalene-1-carbonyl)piperidine-4-carbonyl]amino]benzoate
CID 55430267
1-(naphthalene-1-carbonyl)-N-(5-piperidin-1-yl-2-pyridinyl)piperidine-4-carboxamide
CID 71895394

Frequently Asked Questions

What is the IUPAC name of 1-(naphthalene-1-carbonyl)-N-pyridin-4-ylpiperidine-4-carboxamide?
The IUPAC name of 1-(naphthalene-1-carbonyl)-N-pyridin-4-ylpiperidine-4-carboxamide (CID 27700417) is 1-(naphthalene-1-carbonyl)-N-pyridin-4-ylpiperidine-4-carboxamide.
What is the SMILES notation for 1-(naphthalene-1-carbonyl)-N-pyridin-4-ylpiperidine-4-carboxamide?
The canonical SMILES for 1-(naphthalene-1-carbonyl)-N-pyridin-4-ylpiperidine-4-carboxamide is O=C(Nc1ccncc1)C1CCN(C(=O)c2cccc3ccccc23)CC1.
What is the InChIKey of 1-(naphthalene-1-carbonyl)-N-pyridin-4-ylpiperidine-4-carboxamide?
The InChIKey is UIWVGGIOEKBLOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O2/c26-21(24-18-8-12-23-13-9-18)17-10-14-25(15-11-17)22(27)20-7-3-5-16-4-1-2-6-19(16)20/h1-9,12-13,17H,10-11,14-15H2,(H,23,24,26).
What are the key properties of 1-(naphthalene-1-carbonyl)-N-pyridin-4-ylpiperidine-4-carboxamide?
1-(naphthalene-1-carbonyl)-N-pyridin-4-ylpiperidine-4-carboxamide has a molecular weight of 359.43 g/mol, XLogP of 3.73, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(naphthalene-1-carbonyl)-N-pyridin-4-ylpiperidine-4-carboxamide is sourced from PubChem (CID 27700417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).