N-(4-fluoro-2-methylphenyl)-3-methoxypiperidine-1-carboxamide

C14H19FN2O2 — CID 118763399

IUPACN-(4-fluoro-2-methylphenyl)-3-methoxypiperidine-1-carboxamide
SMILESCOC1CCCN(C(=O)Nc2ccc(F)cc2C)C1
InChIInChI=1S/C14H19FN2O2/c1-10-8-11(15)5-6-13(10)16-14(18)17-7-3-4-12(9-17)19-2/h5-6,8,12H,3-4,7,9H2,1-2H3,(H,16,18)
InChIKeyPYPPWWOCUZZAJH-UHFFFAOYSA-N
MW266.32 g/mol
LogP2.78
Rot. Bonds2

About N-(4-fluoro-2-methylphenyl)-3-methoxypiperidine-1-carboxamide

N-(4-fluoro-2-methylphenyl)-3-methoxypiperidine-1-carboxamide (PubChem CID 118763399) has the molecular formula C14H19FN2O2 and a molecular weight of 266.32 g/mol. Its IUPAC name is N-(4-fluoro-2-methylphenyl)-3-methoxypiperidine-1-carboxamide.

Molecular Properties

Compound NameN-(4-fluoro-2-methylphenyl)-3-methoxypiperidine-1-carboxamide
PubChem CID118763399
Molecular FormulaC14H19FN2O2
Molecular Weight266.32 g/mol
Exact Mass266.14
IUPAC NameN-(4-fluoro-2-methylphenyl)-3-methoxypiperidine-1-carboxamide
SMILESCOC1CCCN(C(=O)Nc2ccc(F)cc2C)C1
InChIInChI=1S/C14H19FN2O2/c1-10-8-11(15)5-6-13(10)16-14(18)17-7-3-4-12(9-17)19-2/h5-6,8,12H,3-4,7,9H2,1-2H3,(H,16,18)
InChIKeyPYPPWWOCUZZAJH-UHFFFAOYSA-N
XLogP2.78
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.32
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-N-(5-carbamoyl-2-methylphenyl)-3-methoxypiperidine-1-carboxamide
CID 124606170
N-(5-carbamoyl-2-methylphenyl)-3-methoxypiperidine-1-carboxamide
CID 118788092
methyl 1-[(2,4-difluorophenyl)carbamoyl]piperidine-3-carboxylate
CID 78915679
(3R)-N-(2,4-dimethyl-5-nitrophenyl)-3-methoxypiperidine-1-carboxamide
CID 99580240
(3S)-3-methoxy-N-(2-methyl-5-sulfamoylphenyl)piperidine-1-carboxamide
CID 125176909
tert-butyl (2S)-1-[(4-fluoro-2-methylphenyl)carbamoyl]pyrrolidine-2-carboxylate
CID 71914636
methyl 3-methyl-4-[[(3R)-3-propoxypiperidine-1-carbonyl]amino]benzoate
CID 95198757
2-hydroxy-3-[(3-methoxypiperidine-1-carbonyl)amino]benzoic acid
CID 102963077
(3S)-3-amino-N-(4-methoxy-2-methylphenyl)piperidine-1-carboxamide
CID 125179914
4-[(3-methoxypiperidine-1-carbonyl)amino]benzoic acid
CID 102962894
(3R)-3-amino-N-(2,4-difluorophenyl)piperidine-1-carboxamide
CID 102984073
(4S)-N-(2,4-difluorophenyl)-4-(dimethylamino)azepane-1-carboxamide
CID 95723660

Frequently Asked Questions

What is the IUPAC name of N-(4-fluoro-2-methylphenyl)-3-methoxypiperidine-1-carboxamide?
The IUPAC name of N-(4-fluoro-2-methylphenyl)-3-methoxypiperidine-1-carboxamide (CID 118763399) is N-(4-fluoro-2-methylphenyl)-3-methoxypiperidine-1-carboxamide.
What is the SMILES notation for N-(4-fluoro-2-methylphenyl)-3-methoxypiperidine-1-carboxamide?
The canonical SMILES for N-(4-fluoro-2-methylphenyl)-3-methoxypiperidine-1-carboxamide is COC1CCCN(C(=O)Nc2ccc(F)cc2C)C1.
What is the InChIKey of N-(4-fluoro-2-methylphenyl)-3-methoxypiperidine-1-carboxamide?
The InChIKey is PYPPWWOCUZZAJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O2/c1-10-8-11(15)5-6-13(10)16-14(18)17-7-3-4-12(9-17)19-2/h5-6,8,12H,3-4,7,9H2,1-2H3,(H,16,18).
What are the key properties of N-(4-fluoro-2-methylphenyl)-3-methoxypiperidine-1-carboxamide?
N-(4-fluoro-2-methylphenyl)-3-methoxypiperidine-1-carboxamide has a molecular weight of 266.32 g/mol, XLogP of 2.78, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluoro-2-methylphenyl)-3-methoxypiperidine-1-carboxamide is sourced from PubChem (CID 118763399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).