4-(2-ethylpiperidine-1-carbonyl)-N-(2-methoxy-5-methylphenyl)cyclohexane-1-carboxamide

C23H34N2O3 — CID 109150023

IUPAC4-(2-ethylpiperidine-1-carbonyl)-N-(2-methoxy-5-methylphenyl)cyclohexane-1-carboxamide
SMILESCCC1CCCCN1C(=O)C1CCC(C(=O)Nc2cc(C)ccc2OC)CC1
InChIInChI=1S/C23H34N2O3/c1-4-19-7-5-6-14-25(19)23(27)18-11-9-17(10-12-18)22(26)24-20-15-16(2)8-13-21(20)28-3/h8,13,15,17-19H,4-7,9-12,14H2,1-3H3,(H,24,26)
InChIKeyWNHVYTMFKDFVBT-UHFFFAOYSA-N
MW386.54 g/mol
LogP4.54
Rot. Bonds5

About 4-(2-ethylpiperidine-1-carbonyl)-N-(2-methoxy-5-methylphenyl)cyclohexane-1-carboxamide

4-(2-ethylpiperidine-1-carbonyl)-N-(2-methoxy-5-methylphenyl)cyclohexane-1-carboxamide (PubChem CID 109150023) has the molecular formula C23H34N2O3 and a molecular weight of 386.54 g/mol. Its IUPAC name is 4-(2-ethylpiperidine-1-carbonyl)-N-(2-methoxy-5-methylphenyl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name4-(2-ethylpiperidine-1-carbonyl)-N-(2-methoxy-5-methylphenyl)cyclohexane-1-carboxamide
PubChem CID109150023
Molecular FormulaC23H34N2O3
Molecular Weight386.54 g/mol
Exact Mass386.26
IUPAC Name4-(2-ethylpiperidine-1-carbonyl)-N-(2-methoxy-5-methylphenyl)cyclohexane-1-carboxamide
SMILESCCC1CCCCN1C(=O)C1CCC(C(=O)Nc2cc(C)ccc2OC)CC1
InChIInChI=1S/C23H34N2O3/c1-4-19-7-5-6-14-25(19)23(27)18-11-9-17(10-12-18)22(26)24-20-15-16(2)8-13-21(20)28-3/h8,13,15,17-19H,4-7,9-12,14H2,1-3H3,(H,24,26)
InChIKeyWNHVYTMFKDFVBT-UHFFFAOYSA-N
XLogP4.54
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.54
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-ethylpiperidine-1-carbonyl)-N-(2-methoxy-5-methylphenyl)cyclopropane-1-carboxamide
CID 108980063
N-(2-methoxy-5-methylphenyl)-4-(4-methylpiperazine-1-carbonyl)cyclohexane-1-carboxamide
CID 109147450
N-(2-methoxy-5-methylphenyl)-1-(piperidine-4-carbonyl)pyrrolidine-2-carboxamide
CID 119327957
1-N-(4-ethylphenyl)-4-N-(2-methoxy-5-methylphenyl)cyclohexane-1,4-dicarboxamide
CID 109150784
1-N-(2-methoxy-5-methylphenyl)-4-N-propan-2-ylcyclohexane-1,4-dicarboxamide
CID 109144583
(2S)-N-(5-bromo-2-methoxyphenyl)-2-ethylpiperidine-1-carboxamide
CID 97313947
1-N-cyclopropyl-4-N-(2-methoxy-5-methylphenyl)cyclohexane-1,4-dicarboxamide
CID 109144779
1-N,3-N-bis(2-methoxy-5-methylphenyl)cyclohexane-1,3-dicarboxamide
CID 60594031
N-(2,5-dimethoxyphenyl)-2-(2-ethylpiperidin-1-yl)-2-oxoacetamide
CID 108511917
4-(2-ethylpiperidine-1-carbonyl)-N-(4-fluorophenyl)cyclohexane-1-carboxamide
CID 109150013
N-(2-methoxy-5-methylphenyl)-2-(1-methylpiperidin-2-yl)acetamide
CID 110860294
N-(2-methoxy-5-methylphenyl)-1-propylsulfonylpiperidine-4-carboxamide
CID 113007617

Frequently Asked Questions

What is the IUPAC name of 4-(2-ethylpiperidine-1-carbonyl)-N-(2-methoxy-5-methylphenyl)cyclohexane-1-carboxamide?
The IUPAC name of 4-(2-ethylpiperidine-1-carbonyl)-N-(2-methoxy-5-methylphenyl)cyclohexane-1-carboxamide (CID 109150023) is 4-(2-ethylpiperidine-1-carbonyl)-N-(2-methoxy-5-methylphenyl)cyclohexane-1-carboxamide.
What is the SMILES notation for 4-(2-ethylpiperidine-1-carbonyl)-N-(2-methoxy-5-methylphenyl)cyclohexane-1-carboxamide?
The canonical SMILES for 4-(2-ethylpiperidine-1-carbonyl)-N-(2-methoxy-5-methylphenyl)cyclohexane-1-carboxamide is CCC1CCCCN1C(=O)C1CCC(C(=O)Nc2cc(C)ccc2OC)CC1.
What is the InChIKey of 4-(2-ethylpiperidine-1-carbonyl)-N-(2-methoxy-5-methylphenyl)cyclohexane-1-carboxamide?
The InChIKey is WNHVYTMFKDFVBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H34N2O3/c1-4-19-7-5-6-14-25(19)23(27)18-11-9-17(10-12-18)22(26)24-20-15-16(2)8-13-21(20)28-3/h8,13,15,17-19H,4-7,9-12,14H2,1-3H3,(H,24,26).
What are the key properties of 4-(2-ethylpiperidine-1-carbonyl)-N-(2-methoxy-5-methylphenyl)cyclohexane-1-carboxamide?
4-(2-ethylpiperidine-1-carbonyl)-N-(2-methoxy-5-methylphenyl)cyclohexane-1-carboxamide has a molecular weight of 386.54 g/mol, XLogP of 4.54, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethylpiperidine-1-carbonyl)-N-(2-methoxy-5-methylphenyl)cyclohexane-1-carboxamide is sourced from PubChem (CID 109150023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).