N-(3-chloro-4-methoxyphenyl)-4-ethylpiperidine-4-carboxamide

C15H21ClN2O2 — CID 63127333

IUPACN-(3-chloro-4-methoxyphenyl)-4-ethylpiperidine-4-carboxamide
SMILESCCC1(C(=O)Nc2ccc(OC)c(Cl)c2)CCNCC1
InChIInChI=1S/C15H21ClN2O2/c1-3-15(6-8-17-9-7-15)14(19)18-11-4-5-13(20-2)12(16)10-11/h4-5,10,17H,3,6-9H2,1-2H3,(H,18,19)
InChIKeyOOEFRFDRYBDZCZ-UHFFFAOYSA-N
MW296.80 g/mol
LogP3.07
Rot. Bonds4

About N-(3-chloro-4-methoxyphenyl)-4-ethylpiperidine-4-carboxamide

N-(3-chloro-4-methoxyphenyl)-4-ethylpiperidine-4-carboxamide (PubChem CID 63127333) has the molecular formula C15H21ClN2O2 and a molecular weight of 296.80 g/mol. Its IUPAC name is N-(3-chloro-4-methoxyphenyl)-4-ethylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(3-chloro-4-methoxyphenyl)-4-ethylpiperidine-4-carboxamide
PubChem CID63127333
Molecular FormulaC15H21ClN2O2
Molecular Weight296.80 g/mol
Exact Mass296.13
IUPAC NameN-(3-chloro-4-methoxyphenyl)-4-ethylpiperidine-4-carboxamide
SMILESCCC1(C(=O)Nc2ccc(OC)c(Cl)c2)CCNCC1
InChIInChI=1S/C15H21ClN2O2/c1-3-15(6-8-17-9-7-15)14(19)18-11-4-5-13(20-2)12(16)10-11/h4-5,10,17H,3,6-9H2,1-2H3,(H,18,19)
InChIKeyOOEFRFDRYBDZCZ-UHFFFAOYSA-N
XLogP3.07
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.80
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-chloro-4-methoxyphenyl)-3-ethylpiperidine-3-carboxamide
CID 63132336
N-(4-bromo-3-chlorophenyl)-4-ethylpiperidine-4-carboxamide
CID 107620276
4-ethyl-N-(2-methoxy-4-methylphenyl)piperidine-4-carboxamide
CID 63128400
N-(4-ethoxy-3-methoxyphenyl)-4-(methoxymethyl)piperidine-4-carboxamide
CID 120618116
N-[3-chloro-4-[2-(dimethylamino)ethoxy]phenyl]-4-(methoxymethyl)piperidine-4-carboxamide
CID 120645221
4-ethyl-N-(4-ethylphenyl)piperidine-4-carboxamide
CID 63127797
1-(3-chloro-4-methoxyphenyl)-3-[[(3R)-3-hydroxypyrrolidin-3-yl]methyl]urea
CID 125169385
N-[3-chloro-4-(difluoromethoxy)phenyl]-4-methylpiperidine-4-carboxamide
CID 63122437
1-N-butyl-1-N'-(3-chloro-4-methoxyphenyl)cyclopropane-1,1-dicarboxamide
CID 108971097
3-ethyl-N-(4-methoxyphenyl)pyrrolidine-3-carboxamide
CID 63140483
1-[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]cyclopentane-1-carboxylic acid
CID 43396507
N-(3-chloro-4-methoxyphenyl)-2-piperidin-4-ylacetamide;hydrochloride
CID 119675615

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-methoxyphenyl)-4-ethylpiperidine-4-carboxamide?
The IUPAC name of N-(3-chloro-4-methoxyphenyl)-4-ethylpiperidine-4-carboxamide (CID 63127333) is N-(3-chloro-4-methoxyphenyl)-4-ethylpiperidine-4-carboxamide.
What is the SMILES notation for N-(3-chloro-4-methoxyphenyl)-4-ethylpiperidine-4-carboxamide?
The canonical SMILES for N-(3-chloro-4-methoxyphenyl)-4-ethylpiperidine-4-carboxamide is CCC1(C(=O)Nc2ccc(OC)c(Cl)c2)CCNCC1.
What is the InChIKey of N-(3-chloro-4-methoxyphenyl)-4-ethylpiperidine-4-carboxamide?
The InChIKey is OOEFRFDRYBDZCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21ClN2O2/c1-3-15(6-8-17-9-7-15)14(19)18-11-4-5-13(20-2)12(16)10-11/h4-5,10,17H,3,6-9H2,1-2H3,(H,18,19).
What are the key properties of N-(3-chloro-4-methoxyphenyl)-4-ethylpiperidine-4-carboxamide?
N-(3-chloro-4-methoxyphenyl)-4-ethylpiperidine-4-carboxamide has a molecular weight of 296.80 g/mol, XLogP of 3.07, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-methoxyphenyl)-4-ethylpiperidine-4-carboxamide is sourced from PubChem (CID 63127333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).