2-(1-phenylpiperidin-3-yl)piperidine-1-carboxamide

C17H25N3O — CID 68930873

IUPAC2-(1-phenylpiperidin-3-yl)piperidine-1-carboxamide
SMILESNC(=O)N1CCCCC1C1CCCN(c2ccccc2)C1
InChIInChI=1S/C17H25N3O/c18-17(21)20-12-5-4-10-16(20)14-7-6-11-19(13-14)15-8-2-1-3-9-15/h1-3,8-9,14,16H,4-7,10-13H2,(H2,18,21)
InChIKeyDHSQCOIDHWUCRQ-UHFFFAOYSA-N
MW287.41 g/mol
LogP2.84
Rot. Bonds2

About 2-(1-phenylpiperidin-3-yl)piperidine-1-carboxamide

2-(1-phenylpiperidin-3-yl)piperidine-1-carboxamide (PubChem CID 68930873) has the molecular formula C17H25N3O and a molecular weight of 287.41 g/mol. Its IUPAC name is 2-(1-phenylpiperidin-3-yl)piperidine-1-carboxamide.

Molecular Properties

Compound Name2-(1-phenylpiperidin-3-yl)piperidine-1-carboxamide
PubChem CID68930873
Molecular FormulaC17H25N3O
Molecular Weight287.41 g/mol
Exact Mass287.20
IUPAC Name2-(1-phenylpiperidin-3-yl)piperidine-1-carboxamide
SMILESNC(=O)N1CCCCC1C1CCCN(c2ccccc2)C1
InChIInChI=1S/C17H25N3O/c18-17(21)20-12-5-4-10-16(20)14-7-6-11-19(13-14)15-8-2-1-3-9-15/h1-3,8-9,14,16H,4-7,10-13H2,(H2,18,21)
InChIKeyDHSQCOIDHWUCRQ-UHFFFAOYSA-N
XLogP2.84
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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(1-phenylpiperidin-3-yl)urea
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carbamic acid;1-phenylpiperidine
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[(3R)-1-phenylpiperidin-3-yl]carbamic acid
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2-phenoxypiperidine-1-carboxamide
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(2R)-2-amino-1-(2-cyclohexylpyrrolidin-1-yl)-2-phenylethanone
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2-(1-quinazolin-4-ylpiperidin-4-yl)azepane-1-carboxamide
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4-(3-aminopiperidin-1-yl)benzoic acid
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2-phenylsulfanylpiperidine-1-carboxamide;hydrochloride
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CID 111631043

Frequently Asked Questions

What is the IUPAC name of 2-(1-phenylpiperidin-3-yl)piperidine-1-carboxamide?
The IUPAC name of 2-(1-phenylpiperidin-3-yl)piperidine-1-carboxamide (CID 68930873) is 2-(1-phenylpiperidin-3-yl)piperidine-1-carboxamide.
What is the SMILES notation for 2-(1-phenylpiperidin-3-yl)piperidine-1-carboxamide?
The canonical SMILES for 2-(1-phenylpiperidin-3-yl)piperidine-1-carboxamide is NC(=O)N1CCCCC1C1CCCN(c2ccccc2)C1.
What is the InChIKey of 2-(1-phenylpiperidin-3-yl)piperidine-1-carboxamide?
The InChIKey is DHSQCOIDHWUCRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O/c18-17(21)20-12-5-4-10-16(20)14-7-6-11-19(13-14)15-8-2-1-3-9-15/h1-3,8-9,14,16H,4-7,10-13H2,(H2,18,21).
What are the key properties of 2-(1-phenylpiperidin-3-yl)piperidine-1-carboxamide?
2-(1-phenylpiperidin-3-yl)piperidine-1-carboxamide has a molecular weight of 287.41 g/mol, XLogP of 2.84, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-phenylpiperidin-3-yl)piperidine-1-carboxamide is sourced from PubChem (CID 68930873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).