1-(naphthalene-1-carbonyl)-N-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxamide

C25H33N3O2 — CID 24542998

IUPAC1-(naphthalene-1-carbonyl)-N-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxamide
SMILESCC(C)N1CCC(NC(=O)C2CCCN(C(=O)c3cccc4ccccc34)C2)CC1
InChIInChI=1S/C25H33N3O2/c1-18(2)27-15-12-21(13-16-27)26-24(29)20-9-6-14-28(17-20)25(30)23-11-5-8-19-7-3-4-10-22(19)23/h3-5,7-8,10-11,18,20-21H,6,9,12-17H2,1-2H3,(H,26,29)
InChIKeyUFPOFZFTYVFSEF-UHFFFAOYSA-N
MW407.56 g/mol
LogP3.68
Rot. Bonds4

About 1-(naphthalene-1-carbonyl)-N-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxamide

1-(naphthalene-1-carbonyl)-N-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxamide (PubChem CID 24542998) has the molecular formula C25H33N3O2 and a molecular weight of 407.56 g/mol. Its IUPAC name is 1-(naphthalene-1-carbonyl)-N-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxamide.

Molecular Properties

Compound Name1-(naphthalene-1-carbonyl)-N-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxamide
PubChem CID24542998
Molecular FormulaC25H33N3O2
Molecular Weight407.56 g/mol
Exact Mass407.26
IUPAC Name1-(naphthalene-1-carbonyl)-N-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxamide
SMILESCC(C)N1CCC(NC(=O)C2CCCN(C(=O)c3cccc4ccccc34)C2)CC1
InChIInChI=1S/C25H33N3O2/c1-18(2)27-15-12-21(13-16-27)26-24(29)20-9-6-14-28(17-20)25(30)23-11-5-8-19-7-3-4-10-22(19)23/h3-5,7-8,10-11,18,20-21H,6,9,12-17H2,1-2H3,(H,26,29)
InChIKeyUFPOFZFTYVFSEF-UHFFFAOYSA-N
XLogP3.68
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.56
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-methylbutyl)-1-(naphthalene-1-carbonyl)piperidine-3-carboxamide
CID 51239994
N-[2-(2-methylpropanoylamino)ethyl]-1-(naphthalene-1-carbonyl)piperidine-3-carboxamide
CID 46510601
(3R)-N-ethoxy-1-(naphthalene-1-carbonyl)piperidine-3-carboxamide
CID 31099034
N-(3-methyl-2-morpholin-4-ylbutyl)-1-(naphthalene-1-carbonyl)piperidine-3-carboxamide
CID 134055842
N-cyclohexyl-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 18108639
(3R)-1-(naphthalene-1-carbonyl)piperidine-3-carboxylic acid
CID 7131658
N-hexyl-1-(naphthalene-1-carbonyl)piperidine-3-carboxamide
CID 74627325
N-(2-methoxyethyl)-1-(naphthalene-1-carbonyl)piperidine-3-carboxamide
CID 51239971
(3-methylpiperidin-1-yl)-naphthalen-1-ylmethanone
CID 4284306
N-[[2-[[methyl(propan-2-yl)amino]methyl]phenyl]methyl]-1-(naphthalene-1-carbonyl)piperidine-3-carboxamide
CID 46456130
1-(naphthalene-1-carbonyl)-N-(3-phenylpropyl)piperidine-3-carboxamide
CID 55430075
N-[1-(1-naphthalen-1-ylethyl)piperidin-4-yl]cyclobutanecarboxamide
CID 176652835

Frequently Asked Questions

What is the IUPAC name of 1-(naphthalene-1-carbonyl)-N-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxamide?
The IUPAC name of 1-(naphthalene-1-carbonyl)-N-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxamide (CID 24542998) is 1-(naphthalene-1-carbonyl)-N-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxamide.
What is the SMILES notation for 1-(naphthalene-1-carbonyl)-N-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxamide?
The canonical SMILES for 1-(naphthalene-1-carbonyl)-N-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxamide is CC(C)N1CCC(NC(=O)C2CCCN(C(=O)c3cccc4ccccc34)C2)CC1.
What is the InChIKey of 1-(naphthalene-1-carbonyl)-N-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxamide?
The InChIKey is UFPOFZFTYVFSEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H33N3O2/c1-18(2)27-15-12-21(13-16-27)26-24(29)20-9-6-14-28(17-20)25(30)23-11-5-8-19-7-3-4-10-22(19)23/h3-5,7-8,10-11,18,20-21H,6,9,12-17H2,1-2H3,(H,26,29).
What are the key properties of 1-(naphthalene-1-carbonyl)-N-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxamide?
1-(naphthalene-1-carbonyl)-N-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxamide has a molecular weight of 407.56 g/mol, XLogP of 3.68, 4 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-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxamide is sourced from PubChem (CID 24542998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).