N-[(4-chlorophenyl)methyl]-4-methoxypiperidine-4-carboxamide

C14H19ClN2O2 — CID 119669752

IUPACN-[(4-chlorophenyl)methyl]-4-methoxypiperidine-4-carboxamide
SMILESCOC1(C(=O)NCc2ccc(Cl)cc2)CCNCC1
InChIInChI=1S/C14H19ClN2O2/c1-19-14(6-8-16-9-7-14)13(18)17-10-11-2-4-12(15)5-3-11/h2-5,16H,6-10H2,1H3,(H,17,18)
InChIKeySIGLEGBWDPZJDN-UHFFFAOYSA-N
MW282.77 g/mol
LogP1.72
Rot. Bonds4

About N-[(4-chlorophenyl)methyl]-4-methoxypiperidine-4-carboxamide

N-[(4-chlorophenyl)methyl]-4-methoxypiperidine-4-carboxamide (PubChem CID 119669752) has the molecular formula C14H19ClN2O2 and a molecular weight of 282.77 g/mol. Its IUPAC name is N-[(4-chlorophenyl)methyl]-4-methoxypiperidine-4-carboxamide.

Molecular Properties

Compound NameN-[(4-chlorophenyl)methyl]-4-methoxypiperidine-4-carboxamide
PubChem CID119669752
Molecular FormulaC14H19ClN2O2
Molecular Weight282.77 g/mol
Exact Mass282.11
IUPAC NameN-[(4-chlorophenyl)methyl]-4-methoxypiperidine-4-carboxamide
SMILESCOC1(C(=O)NCc2ccc(Cl)cc2)CCNCC1
InChIInChI=1S/C14H19ClN2O2/c1-19-14(6-8-16-9-7-14)13(18)17-10-11-2-4-12(15)5-3-11/h2-5,16H,6-10H2,1H3,(H,17,18)
InChIKeySIGLEGBWDPZJDN-UHFFFAOYSA-N
XLogP1.72
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.77
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-methoxy-N-[(4-propan-2-ylphenyl)methyl]piperidine-4-carboxamide
CID 119716391
4-methoxy-N-[[4-(methylcarbamoyl)phenyl]methyl]piperidine-4-carboxamide;hydrochloride
CID 119712888
N-[[4-(4-fluorophenoxy)phenyl]methyl]-4-methoxypiperidine-4-carboxamide
CID 119696231
N-[[4-(ethoxymethyl)phenyl]methyl]-4-methoxypiperidine-4-carboxamide;hydrochloride
CID 119718289
4-methoxy-N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]piperidine-4-carboxamide;dihydrochloride
CID 119836245
N-(4-chlorophenyl)-4-methoxypiperidine-4-carboxamide
CID 119671235
N-[(3-fluoro-4-methylphenyl)methyl]-4-methoxypiperidine-4-carboxamide;hydrochloride
CID 119697511
ethyl 4-[[(4-methoxypiperidine-4-carbonyl)amino]methyl]benzoate;hydrochloride
CID 119746522
N-[[1-(4-chlorophenyl)cyclobutyl]methyl]-4-methoxypiperidine-4-carboxamide
CID 119769965
4-methoxy-N-[(6-methoxynaphthalen-2-yl)methyl]piperidine-4-carboxamide
CID 119699303
4-methoxy-N-[(3-methoxyphenyl)methyl]piperidine-4-carboxamide
CID 119678226
methyl 4-[4-[[(4-methoxypiperidine-4-carbonyl)amino]methyl]phenoxy]butanoate
CID 119787961

Frequently Asked Questions

What is the IUPAC name of N-[(4-chlorophenyl)methyl]-4-methoxypiperidine-4-carboxamide?
The IUPAC name of N-[(4-chlorophenyl)methyl]-4-methoxypiperidine-4-carboxamide (CID 119669752) is N-[(4-chlorophenyl)methyl]-4-methoxypiperidine-4-carboxamide.
What is the SMILES notation for N-[(4-chlorophenyl)methyl]-4-methoxypiperidine-4-carboxamide?
The canonical SMILES for N-[(4-chlorophenyl)methyl]-4-methoxypiperidine-4-carboxamide is COC1(C(=O)NCc2ccc(Cl)cc2)CCNCC1.
What is the InChIKey of N-[(4-chlorophenyl)methyl]-4-methoxypiperidine-4-carboxamide?
The InChIKey is SIGLEGBWDPZJDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O2/c1-19-14(6-8-16-9-7-14)13(18)17-10-11-2-4-12(15)5-3-11/h2-5,16H,6-10H2,1H3,(H,17,18).
What are the key properties of N-[(4-chlorophenyl)methyl]-4-methoxypiperidine-4-carboxamide?
N-[(4-chlorophenyl)methyl]-4-methoxypiperidine-4-carboxamide has a molecular weight of 282.77 g/mol, XLogP of 1.72, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-chlorophenyl)methyl]-4-methoxypiperidine-4-carboxamide is sourced from PubChem (CID 119669752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).