N-(2-ethoxyphenyl)-2-(2-ethylpiperidine-1-carbonyl)pyridine-4-carboxamide

C22H27N3O3 — CID 109090246

IUPACN-(2-ethoxyphenyl)-2-(2-ethylpiperidine-1-carbonyl)pyridine-4-carboxamide
SMILESCCOc1ccccc1NC(=O)c1ccnc(C(=O)N2CCCCC2CC)c1
InChIInChI=1S/C22H27N3O3/c1-3-17-9-7-8-14-25(17)22(27)19-15-16(12-13-23-19)21(26)24-18-10-5-6-11-20(18)28-4-2/h5-6,10-13,15,17H,3-4,7-9,14H2,1-2H3,(H,24,26)
InChIKeyOMXJVHWTTNIINB-UHFFFAOYSA-N
MW381.48 g/mol
LogP4.14
Rot. Bonds6

About N-(2-ethoxyphenyl)-2-(2-ethylpiperidine-1-carbonyl)pyridine-4-carboxamide

N-(2-ethoxyphenyl)-2-(2-ethylpiperidine-1-carbonyl)pyridine-4-carboxamide (PubChem CID 109090246) has the molecular formula C22H27N3O3 and a molecular weight of 381.48 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-2-(2-ethylpiperidine-1-carbonyl)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-2-(2-ethylpiperidine-1-carbonyl)pyridine-4-carboxamide
PubChem CID109090246
Molecular FormulaC22H27N3O3
Molecular Weight381.48 g/mol
Exact Mass381.21
IUPAC NameN-(2-ethoxyphenyl)-2-(2-ethylpiperidine-1-carbonyl)pyridine-4-carboxamide
SMILESCCOc1ccccc1NC(=O)c1ccnc(C(=O)N2CCCCC2CC)c1
InChIInChI=1S/C22H27N3O3/c1-3-17-9-7-8-14-25(17)22(27)19-15-16(12-13-23-19)21(26)24-18-10-5-6-11-20(18)28-4-2/h5-6,10-13,15,17H,3-4,7-9,14H2,1-2H3,(H,24,26)
InChIKeyOMXJVHWTTNIINB-UHFFFAOYSA-N
XLogP4.14
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.48
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-ethoxyphenyl)-3-(2-ethylpiperidine-1-carbonyl)benzamide
CID 109056478
N-(2,5-dimethoxyphenyl)-2-(2-ethylpiperidine-1-carbonyl)pyridine-4-carboxamide
CID 109090251
N-(2-ethoxyphenyl)-2-ethylpiperidine-1-carboxamide
CID 6468578
N-(4-ethylphenyl)-2-(2-ethylpiperidine-1-carbonyl)pyridine-4-carboxamide
CID 109090223
N-(4-tert-butylphenyl)-2-(2-ethylpiperidine-1-carbonyl)pyridine-4-carboxamide
CID 109090231
N-(2-tert-butylphenyl)-4-(2-ethylpiperidine-1-carbonyl)pyridine-2-carboxamide
CID 109090159
5-(2-ethylpiperidine-1-carbonyl)-N-(2-methoxyphenyl)pyridine-3-carboxamide
CID 109107451
N-(2,3-dimethylphenyl)-4-(2-ethylpiperidine-1-carbonyl)pyridine-2-carboxamide
CID 109090150
N-(3-cyanophenyl)-2-(2-ethylpiperidine-1-carbonyl)pyridine-4-carboxamide
CID 109090269
[5-(2-ethoxyanilino)-3-pyridinyl]-(2-ethylpiperidin-1-yl)methanone
CID 109240550
2-(2-ethylpiperidine-1-carbonyl)-N-[(4-methoxyphenyl)methyl]pyridine-4-carboxamide
CID 109086886
N-(2,4-difluorophenyl)-4-(2-ethylpiperidine-1-carbonyl)pyridine-2-carboxamide
CID 109090195

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-2-(2-ethylpiperidine-1-carbonyl)pyridine-4-carboxamide?
The IUPAC name of N-(2-ethoxyphenyl)-2-(2-ethylpiperidine-1-carbonyl)pyridine-4-carboxamide (CID 109090246) is N-(2-ethoxyphenyl)-2-(2-ethylpiperidine-1-carbonyl)pyridine-4-carboxamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-2-(2-ethylpiperidine-1-carbonyl)pyridine-4-carboxamide?
The canonical SMILES for N-(2-ethoxyphenyl)-2-(2-ethylpiperidine-1-carbonyl)pyridine-4-carboxamide is CCOc1ccccc1NC(=O)c1ccnc(C(=O)N2CCCCC2CC)c1.
What is the InChIKey of N-(2-ethoxyphenyl)-2-(2-ethylpiperidine-1-carbonyl)pyridine-4-carboxamide?
The InChIKey is OMXJVHWTTNIINB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27N3O3/c1-3-17-9-7-8-14-25(17)22(27)19-15-16(12-13-23-19)21(26)24-18-10-5-6-11-20(18)28-4-2/h5-6,10-13,15,17H,3-4,7-9,14H2,1-2H3,(H,24,26).
What are the key properties of N-(2-ethoxyphenyl)-2-(2-ethylpiperidine-1-carbonyl)pyridine-4-carboxamide?
N-(2-ethoxyphenyl)-2-(2-ethylpiperidine-1-carbonyl)pyridine-4-carboxamide has a molecular weight of 381.48 g/mol, XLogP of 4.14, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-2-(2-ethylpiperidine-1-carbonyl)pyridine-4-carboxamide is sourced from PubChem (CID 109090246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).