1-(naphthalene-1-carbonyl)-N-[1-(phenylcarbamoyl)piperidin-4-yl]piperidine-4-carboxamide

C29H32N4O3 — CID 134042483

IUPAC1-(naphthalene-1-carbonyl)-N-[1-(phenylcarbamoyl)piperidin-4-yl]piperidine-4-carboxamide
SMILESO=C(NC1CCN(C(=O)Nc2ccccc2)CC1)C1CCN(C(=O)c2cccc3ccccc23)CC1
InChIInChI=1S/C29H32N4O3/c34-27(30-24-15-19-33(20-16-24)29(36)31-23-9-2-1-3-10-23)22-13-17-32(18-14-22)28(35)26-12-6-8-21-7-4-5-11-25(21)26/h1-12,22,24H,13-20H2,(H,30,34)(H,31,36)
InChIKeyBNCRGIYFZMOODA-UHFFFAOYSA-N
MW484.60 g/mol
LogP4.50
Rot. Bonds4

About 1-(naphthalene-1-carbonyl)-N-[1-(phenylcarbamoyl)piperidin-4-yl]piperidine-4-carboxamide

1-(naphthalene-1-carbonyl)-N-[1-(phenylcarbamoyl)piperidin-4-yl]piperidine-4-carboxamide (PubChem CID 134042483) has the molecular formula C29H32N4O3 and a molecular weight of 484.60 g/mol. Its IUPAC name is 1-(naphthalene-1-carbonyl)-N-[1-(phenylcarbamoyl)piperidin-4-yl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(naphthalene-1-carbonyl)-N-[1-(phenylcarbamoyl)piperidin-4-yl]piperidine-4-carboxamide
PubChem CID134042483
Molecular FormulaC29H32N4O3
Molecular Weight484.60 g/mol
Exact Mass484.25
IUPAC Name1-(naphthalene-1-carbonyl)-N-[1-(phenylcarbamoyl)piperidin-4-yl]piperidine-4-carboxamide
SMILESO=C(NC1CCN(C(=O)Nc2ccccc2)CC1)C1CCN(C(=O)c2cccc3ccccc23)CC1
InChIInChI=1S/C29H32N4O3/c34-27(30-24-15-19-33(20-16-24)29(36)31-23-9-2-1-3-10-23)22-13-17-32(18-14-22)28(35)26-12-6-8-21-7-4-5-11-25(21)26/h1-12,22,24H,13-20H2,(H,30,34)(H,31,36)
InChIKeyBNCRGIYFZMOODA-UHFFFAOYSA-N
XLogP4.50
TPSA81.75 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500484.60
LogP ≤ 54.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclohexyl-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 18108639
1-(naphthalene-1-carbonyl)-N-pyridin-4-ylpiperidine-4-carboxamide
CID 27700417
N-[1-(naphthalene-1-carbonyl)piperidin-4-yl]naphthalene-1-carboxamide
CID 108554043
2-[4-(cyclopropanecarbonylamino)piperidine-1-carbonyl]benzoic acid
CID 113083284
N-[4-(diethylamino)phenyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 46581827
1-N-phenyl-4-N-[1-(pyridin-4-ylmethyl)piperidin-4-yl]piperidine-1,4-dicarboxamide
CID 138041926
N-(2-fluorophenyl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 27396109
4-[(2-chlorobenzoyl)amino]-N-phenylpiperidine-1-carboxamide
CID 51324372
N-(2,3-dihydro-1H-inden-1-yl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 51273823
4-N-(1-naphthalen-1-ylethyl)-1-N-phenylpiperidine-1,4-dicarboxamide
CID 42907490
azepan-1-yl-[1-(naphthalene-1-carbonyl)piperidin-4-yl]methanone
CID 27659108
N-phenyl-4-(pyrrolidine-3-carbonylamino)piperidine-1-carboxamide;hydrochloride
CID 119700260

Frequently Asked Questions

What is the IUPAC name of 1-(naphthalene-1-carbonyl)-N-[1-(phenylcarbamoyl)piperidin-4-yl]piperidine-4-carboxamide?
The IUPAC name of 1-(naphthalene-1-carbonyl)-N-[1-(phenylcarbamoyl)piperidin-4-yl]piperidine-4-carboxamide (CID 134042483) is 1-(naphthalene-1-carbonyl)-N-[1-(phenylcarbamoyl)piperidin-4-yl]piperidine-4-carboxamide.
What is the SMILES notation for 1-(naphthalene-1-carbonyl)-N-[1-(phenylcarbamoyl)piperidin-4-yl]piperidine-4-carboxamide?
The canonical SMILES for 1-(naphthalene-1-carbonyl)-N-[1-(phenylcarbamoyl)piperidin-4-yl]piperidine-4-carboxamide is O=C(NC1CCN(C(=O)Nc2ccccc2)CC1)C1CCN(C(=O)c2cccc3ccccc23)CC1.
What is the InChIKey of 1-(naphthalene-1-carbonyl)-N-[1-(phenylcarbamoyl)piperidin-4-yl]piperidine-4-carboxamide?
The InChIKey is BNCRGIYFZMOODA-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H32N4O3/c34-27(30-24-15-19-33(20-16-24)29(36)31-23-9-2-1-3-10-23)22-13-17-32(18-14-22)28(35)26-12-6-8-21-7-4-5-11-25(21)26/h1-12,22,24H,13-20H2,(H,30,34)(H,31,36).
What are the key properties of 1-(naphthalene-1-carbonyl)-N-[1-(phenylcarbamoyl)piperidin-4-yl]piperidine-4-carboxamide?
1-(naphthalene-1-carbonyl)-N-[1-(phenylcarbamoyl)piperidin-4-yl]piperidine-4-carboxamide has a molecular weight of 484.60 g/mol, XLogP of 4.50, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(naphthalene-1-carbonyl)-N-[1-(phenylcarbamoyl)piperidin-4-yl]piperidine-4-carboxamide is sourced from PubChem (CID 134042483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).