1-(naphthalene-1-carbonyl)-N-(5-piperidin-1-yl-2-pyridinyl)piperidine-4-carboxamide

C27H30N4O2 — CID 71895394

IUPAC1-(naphthalene-1-carbonyl)-N-(5-piperidin-1-yl-2-pyridinyl)piperidine-4-carboxamide
SMILESO=C(Nc1ccc(N2CCCCC2)cn1)C1CCN(C(=O)c2cccc3ccccc23)CC1
InChIInChI=1S/C27H30N4O2/c32-26(29-25-12-11-22(19-28-25)30-15-4-1-5-16-30)21-13-17-31(18-14-21)27(33)24-10-6-8-20-7-2-3-9-23(20)24/h2-3,6-12,19,21H,1,4-5,13-18H2,(H,28,29,32)
InChIKeyLQHCOQZGMABRCH-UHFFFAOYSA-N
MW442.56 g/mol
LogP4.72
Rot. Bonds4

About 1-(naphthalene-1-carbonyl)-N-(5-piperidin-1-yl-2-pyridinyl)piperidine-4-carboxamide

1-(naphthalene-1-carbonyl)-N-(5-piperidin-1-yl-2-pyridinyl)piperidine-4-carboxamide (PubChem CID 71895394) has the molecular formula C27H30N4O2 and a molecular weight of 442.56 g/mol. Its IUPAC name is 1-(naphthalene-1-carbonyl)-N-(5-piperidin-1-yl-2-pyridinyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(naphthalene-1-carbonyl)-N-(5-piperidin-1-yl-2-pyridinyl)piperidine-4-carboxamide
PubChem CID71895394
Molecular FormulaC27H30N4O2
Molecular Weight442.56 g/mol
Exact Mass442.24
IUPAC Name1-(naphthalene-1-carbonyl)-N-(5-piperidin-1-yl-2-pyridinyl)piperidine-4-carboxamide
SMILESO=C(Nc1ccc(N2CCCCC2)cn1)C1CCN(C(=O)c2cccc3ccccc23)CC1
InChIInChI=1S/C27H30N4O2/c32-26(29-25-12-11-22(19-28-25)30-15-4-1-5-16-30)21-13-17-31(18-14-21)27(33)24-10-6-8-20-7-2-3-9-23(20)24/h2-3,6-12,19,21H,1,4-5,13-18H2,(H,28,29,32)
InChIKeyLQHCOQZGMABRCH-UHFFFAOYSA-N
XLogP4.72
TPSA65.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500442.56
LogP ≤ 54.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-(azepan-1-yl)-2-pyridinyl]cyclobutanecarboxamide
CID 113031088
N-cyclohexyl-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 18108639
1-(naphthalene-1-carbonyl)-N-pyridin-4-ylpiperidine-4-carboxamide
CID 27700417
azepan-1-yl-[1-(naphthalene-1-carbonyl)piperidin-4-yl]methanone
CID 27659108
N-(3-chloro-4-piperidin-1-ylphenyl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 55884883
1-(naphthalene-1-carbonyl)-N-(1,3-thiazol-2-yl)piperidine-4-carboxamide
CID 17447647
1-[(E)-3-phenylprop-2-enoyl]-N-(5-pyrrolidin-1-yl-2-pyridinyl)piperidine-4-carboxamide
CID 32951936
N-(2-fluorophenyl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 27396109
2-naphthalen-1-yl-N-[2-oxo-2-[(5-piperidin-1-yl-2-pyridinyl)amino]ethyl]acetamide
CID 78878188
methyl 2-[[1-(naphthalene-1-carbonyl)piperidine-4-carbonyl]amino]benzoate
CID 55430267
N-[5-[4-(cyclopropanecarbonyl)piperazin-1-yl]-2-pyridinyl]cyclopropanecarboxamide
CID 75420475
1-(naphthalene-1-carbonyl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide
CID 17465771

Frequently Asked Questions

What is the IUPAC name of 1-(naphthalene-1-carbonyl)-N-(5-piperidin-1-yl-2-pyridinyl)piperidine-4-carboxamide?
The IUPAC name of 1-(naphthalene-1-carbonyl)-N-(5-piperidin-1-yl-2-pyridinyl)piperidine-4-carboxamide (CID 71895394) is 1-(naphthalene-1-carbonyl)-N-(5-piperidin-1-yl-2-pyridinyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(naphthalene-1-carbonyl)-N-(5-piperidin-1-yl-2-pyridinyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(naphthalene-1-carbonyl)-N-(5-piperidin-1-yl-2-pyridinyl)piperidine-4-carboxamide is O=C(Nc1ccc(N2CCCCC2)cn1)C1CCN(C(=O)c2cccc3ccccc23)CC1.
What is the InChIKey of 1-(naphthalene-1-carbonyl)-N-(5-piperidin-1-yl-2-pyridinyl)piperidine-4-carboxamide?
The InChIKey is LQHCOQZGMABRCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H30N4O2/c32-26(29-25-12-11-22(19-28-25)30-15-4-1-5-16-30)21-13-17-31(18-14-21)27(33)24-10-6-8-20-7-2-3-9-23(20)24/h2-3,6-12,19,21H,1,4-5,13-18H2,(H,28,29,32).
What are the key properties of 1-(naphthalene-1-carbonyl)-N-(5-piperidin-1-yl-2-pyridinyl)piperidine-4-carboxamide?
1-(naphthalene-1-carbonyl)-N-(5-piperidin-1-yl-2-pyridinyl)piperidine-4-carboxamide has a molecular weight of 442.56 g/mol, XLogP of 4.72, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(naphthalene-1-carbonyl)-N-(5-piperidin-1-yl-2-pyridinyl)piperidine-4-carboxamide is sourced from PubChem (CID 71895394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).