N-methyl-1-(2-phenylbutanoyl)piperidine-4-carboxamide

C17H24N2O2 — CID 43064111

IUPACN-methyl-1-(2-phenylbutanoyl)piperidine-4-carboxamide
SMILESCCC(C(=O)N1CCC(C(=O)NC)CC1)c1ccccc1
InChIInChI=1S/C17H24N2O2/c1-3-15(13-7-5-4-6-8-13)17(21)19-11-9-14(10-12-19)16(20)18-2/h4-8,14-15H,3,9-12H2,1-2H3,(H,18,20)
InChIKeyUUYUVUBHXBSINC-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.16
Rot. Bonds4

About N-methyl-1-(2-phenylbutanoyl)piperidine-4-carboxamide

N-methyl-1-(2-phenylbutanoyl)piperidine-4-carboxamide (PubChem CID 43064111) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is N-methyl-1-(2-phenylbutanoyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-methyl-1-(2-phenylbutanoyl)piperidine-4-carboxamide
PubChem CID43064111
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC NameN-methyl-1-(2-phenylbutanoyl)piperidine-4-carboxamide
SMILESCCC(C(=O)N1CCC(C(=O)NC)CC1)c1ccccc1
InChIInChI=1S/C17H24N2O2/c1-3-15(13-7-5-4-6-8-13)17(21)19-11-9-14(10-12-19)16(20)18-2/h4-8,14-15H,3,9-12H2,1-2H3,(H,18,20)
InChIKeyUUYUVUBHXBSINC-UHFFFAOYSA-N
XLogP2.16
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,2-diphenylacetyl)-N-methylpiperidine-4-carboxamide
CID 110350749
N-[1-(2-phenylbutanoyl)piperidin-4-yl]piperidine-4-carboxamide
CID 119311950
1-[3-(methylaminomethyl)pyrrolidin-1-yl]-2-phenylbutan-1-one
CID 63264037
N-butan-2-yl-1-(2,2-diphenylacetyl)piperidine-4-carboxamide
CID 113002830
1-[3-(bromomethyl)pyrrolidin-1-yl]-2-phenylbutan-1-one
CID 80667782
1-ethyl-3-[1-[(2R)-2-phenylbutanoyl]piperidin-4-yl]urea
CID 95303034
(1S,6R)-N-[1-[(2S)-2-phenylbutanoyl]piperidin-4-yl]bicyclo[4.1.0]heptane-7-carboxamide
CID 95906118
1-(2-phenylpentanoyl)piperidine-4-carboxylic acid
CID 75416877
3-amino-N-[1-(2-phenylbutanoyl)piperidin-4-yl]cyclopentane-1-carboxamide;hydrochloride
CID 119763637
1-[4-(methylamino)piperidin-1-yl]-2-phenylpentan-1-one
CID 119560444
(2S)-1-morpholin-4-yl-2-phenylbutan-1-one
CID 670056
1-(4-cyclopropylidenepiperidin-1-yl)-2-phenylbutan-1-one
CID 121186844

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-phenylbutanoyl)piperidine-4-carboxamide?
The IUPAC name of N-methyl-1-(2-phenylbutanoyl)piperidine-4-carboxamide (CID 43064111) is N-methyl-1-(2-phenylbutanoyl)piperidine-4-carboxamide.
What is the SMILES notation for N-methyl-1-(2-phenylbutanoyl)piperidine-4-carboxamide?
The canonical SMILES for N-methyl-1-(2-phenylbutanoyl)piperidine-4-carboxamide is CCC(C(=O)N1CCC(C(=O)NC)CC1)c1ccccc1.
What is the InChIKey of N-methyl-1-(2-phenylbutanoyl)piperidine-4-carboxamide?
The InChIKey is UUYUVUBHXBSINC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-3-15(13-7-5-4-6-8-13)17(21)19-11-9-14(10-12-19)16(20)18-2/h4-8,14-15H,3,9-12H2,1-2H3,(H,18,20).
What are the key properties of N-methyl-1-(2-phenylbutanoyl)piperidine-4-carboxamide?
N-methyl-1-(2-phenylbutanoyl)piperidine-4-carboxamide has a molecular weight of 288.39 g/mol, XLogP of 2.16, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-phenylbutanoyl)piperidine-4-carboxamide is sourced from PubChem (CID 43064111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).