4-methyl-N,N,4-triphenylpiperidine-1-carboxamide

C25H26N2O — CID 21022116

IUPAC4-methyl-N,N,4-triphenylpiperidine-1-carboxamide
SMILESCC1(c2ccccc2)CCN(C(=O)N(c2ccccc2)c2ccccc2)CC1
InChIInChI=1S/C25H26N2O/c1-25(21-11-5-2-6-12-21)17-19-26(20-18-25)24(28)27(22-13-7-3-8-14-22)23-15-9-4-10-16-23/h2-16H,17-20H2,1H3
InChIKeyIXMXBIPWUOYMLU-UHFFFAOYSA-N
MW370.50 g/mol
LogP6.00
Rot. Bonds3

About 4-methyl-N,N,4-triphenylpiperidine-1-carboxamide

4-methyl-N,N,4-triphenylpiperidine-1-carboxamide (PubChem CID 21022116) has the molecular formula C25H26N2O and a molecular weight of 370.50 g/mol. Its IUPAC name is 4-methyl-N,N,4-triphenylpiperidine-1-carboxamide.

Molecular Properties

Compound Name4-methyl-N,N,4-triphenylpiperidine-1-carboxamide
PubChem CID21022116
Molecular FormulaC25H26N2O
Molecular Weight370.50 g/mol
Exact Mass370.20
IUPAC Name4-methyl-N,N,4-triphenylpiperidine-1-carboxamide
SMILESCC1(c2ccccc2)CCN(C(=O)N(c2ccccc2)c2ccccc2)CC1
InChIInChI=1S/C25H26N2O/c1-25(21-11-5-2-6-12-21)17-19-26(20-18-25)24(28)27(22-13-7-3-8-14-22)23-15-9-4-10-16-23/h2-16H,17-20H2,1H3
InChIKeyIXMXBIPWUOYMLU-UHFFFAOYSA-N
XLogP6.00
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.50
LogP ≤ 56.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-methyl-3-(4-methyl-4-phenylpiperidin-1-yl)-3-oxopropanoic acid
CID 122065781
2,2-dimethyl-1-(4-methyl-4-phenylpiperidin-1-yl)propan-1-one
CID 142910401
4-methyl-N,N-diphenylpiperidine-1-carboxamide
CID 71122865
(E)-2-methyl-1-(4-methyl-4-phenylpiperidin-1-yl)but-2-en-1-one
CID 174192675
4-methyl-4-phenyl-1-prop-1-en-2-ylpiperidine
CID 145156044
N,N-diphenyl-4-(piperidine-1-carbonyl)piperazine-1-carboxamide
CID 991675
2-[2-(4-methyl-4-phenylpiperidine-1-carbonyl)phenyl]sulfanylpropanoic acid
CID 120549987
2-methylbutan-2-yl 4-methyl-4-phenylpiperidine-1-carboxylate
CID 174192661
4-(2-hydroxyphenyl)-N,N-diphenylpiperazine-1-carboxamide
CID 14302847
2-(4-chlorophenyl)-2-methyl-1-(4-methyl-4-phenylpiperidin-1-yl)propan-1-one
CID 11717371
(2-methoxy-4-propan-2-yloxyphenyl)-(4-methyl-4-phenylpiperidin-1-yl)methanone
CID 138473872
4-(2,3-dimethylphenyl)-N,N-diphenylpiperazine-1-carboxamide
CID 1305709

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N,N,4-triphenylpiperidine-1-carboxamide?
The IUPAC name of 4-methyl-N,N,4-triphenylpiperidine-1-carboxamide (CID 21022116) is 4-methyl-N,N,4-triphenylpiperidine-1-carboxamide.
What is the SMILES notation for 4-methyl-N,N,4-triphenylpiperidine-1-carboxamide?
The canonical SMILES for 4-methyl-N,N,4-triphenylpiperidine-1-carboxamide is CC1(c2ccccc2)CCN(C(=O)N(c2ccccc2)c2ccccc2)CC1.
What is the InChIKey of 4-methyl-N,N,4-triphenylpiperidine-1-carboxamide?
The InChIKey is IXMXBIPWUOYMLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N2O/c1-25(21-11-5-2-6-12-21)17-19-26(20-18-25)24(28)27(22-13-7-3-8-14-22)23-15-9-4-10-16-23/h2-16H,17-20H2,1H3.
What are the key properties of 4-methyl-N,N,4-triphenylpiperidine-1-carboxamide?
4-methyl-N,N,4-triphenylpiperidine-1-carboxamide has a molecular weight of 370.50 g/mol, XLogP of 6.00, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N,N,4-triphenylpiperidine-1-carboxamide is sourced from PubChem (CID 21022116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).