N-ethyl-4-(4-methylpiperidine-1-carbonyl)-N-phenylbenzamide

C22H26N2O2 — CID 109044926

IUPACN-ethyl-4-(4-methylpiperidine-1-carbonyl)-N-phenylbenzamide
SMILESCCN(C(=O)c1ccc(C(=O)N2CCC(C)CC2)cc1)c1ccccc1
InChIInChI=1S/C22H26N2O2/c1-3-24(20-7-5-4-6-8-20)22(26)19-11-9-18(10-12-19)21(25)23-15-13-17(2)14-16-23/h4-12,17H,3,13-16H2,1-2H3
InChIKeySLKLUKQFAORUIR-UHFFFAOYSA-N
MW350.46 g/mol
LogP4.23
Rot. Bonds4

About N-ethyl-4-(4-methylpiperidine-1-carbonyl)-N-phenylbenzamide

N-ethyl-4-(4-methylpiperidine-1-carbonyl)-N-phenylbenzamide (PubChem CID 109044926) has the molecular formula C22H26N2O2 and a molecular weight of 350.46 g/mol. Its IUPAC name is N-ethyl-4-(4-methylpiperidine-1-carbonyl)-N-phenylbenzamide.

Molecular Properties

Compound NameN-ethyl-4-(4-methylpiperidine-1-carbonyl)-N-phenylbenzamide
PubChem CID109044926
Molecular FormulaC22H26N2O2
Molecular Weight350.46 g/mol
Exact Mass350.20
IUPAC NameN-ethyl-4-(4-methylpiperidine-1-carbonyl)-N-phenylbenzamide
SMILESCCN(C(=O)c1ccc(C(=O)N2CCC(C)CC2)cc1)c1ccccc1
InChIInChI=1S/C22H26N2O2/c1-3-24(20-7-5-4-6-8-20)22(26)19-11-9-18(10-12-19)21(25)23-15-13-17(2)14-16-23/h4-12,17H,3,13-16H2,1-2H3
InChIKeySLKLUKQFAORUIR-UHFFFAOYSA-N
XLogP4.23
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 54.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-3-[[2-[4-(4-methylpiperidine-1-carbonyl)anilino]-2-oxoethyl]amino]-N-phenylbenzamide
CID 54838658
[4-[(4-benzylpiperazin-1-yl)methyl]phenyl]-(4-methylpiperidin-1-yl)methanone
CID 126191918
N-ethyl-N-(3-methylphenyl)-4-(piperidine-1-carbonyl)benzamide
CID 109044713
[4-(4-methylpiperidine-1-carbonyl)phenyl]-pyrrolidin-1-ylmethanone
CID 109044208
4-(dimethylamino)-N-ethyl-N-phenylbenzamide
CID 110757236
(4-methylphenyl)-(4-methylpiperidin-1-yl)methanone
CID 723102
N-methyl-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]benzenesulfonamide
CID 1107832
2-[4-(azepane-1-carbonyl)anilino]-N-ethyl-N-phenylacetamide
CID 54835196
(4-methylpiperidin-1-yl)-[4-(phenylsulfanylmethyl)phenyl]methanone
CID 17312948
4-[(1-benzoylpiperidin-4-yl)-propylcarbamoyl]benzoic acid
CID 119183312
(4-methylpiperidin-1-yl)-[4-[(4-phenylpiperazin-1-yl)methyl]phenyl]methanone
CID 1137062
4-(1,3-dithiolan-2-yl)-N-ethyl-N-phenylbenzamide
CID 86977726

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-(4-methylpiperidine-1-carbonyl)-N-phenylbenzamide?
The IUPAC name of N-ethyl-4-(4-methylpiperidine-1-carbonyl)-N-phenylbenzamide (CID 109044926) is N-ethyl-4-(4-methylpiperidine-1-carbonyl)-N-phenylbenzamide.
What is the SMILES notation for N-ethyl-4-(4-methylpiperidine-1-carbonyl)-N-phenylbenzamide?
The canonical SMILES for N-ethyl-4-(4-methylpiperidine-1-carbonyl)-N-phenylbenzamide is CCN(C(=O)c1ccc(C(=O)N2CCC(C)CC2)cc1)c1ccccc1.
What is the InChIKey of N-ethyl-4-(4-methylpiperidine-1-carbonyl)-N-phenylbenzamide?
The InChIKey is SLKLUKQFAORUIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O2/c1-3-24(20-7-5-4-6-8-20)22(26)19-11-9-18(10-12-19)21(25)23-15-13-17(2)14-16-23/h4-12,17H,3,13-16H2,1-2H3.
What are the key properties of N-ethyl-4-(4-methylpiperidine-1-carbonyl)-N-phenylbenzamide?
N-ethyl-4-(4-methylpiperidine-1-carbonyl)-N-phenylbenzamide has a molecular weight of 350.46 g/mol, XLogP of 4.23, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-(4-methylpiperidine-1-carbonyl)-N-phenylbenzamide is sourced from PubChem (CID 109044926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).