N-[(2R)-1-(2-methoxyphenyl)propan-2-yl]-N,6-dimethylpyridine-2-carboxamide

C18H22N2O2 — CID 96567463

IUPACN-[(2R)-1-(2-methoxyphenyl)propan-2-yl]-N,6-dimethylpyridine-2-carboxamide
SMILESCOc1ccccc1C[C@@H](C)N(C)C(=O)c1cccc(C)n1
InChIInChI=1S/C18H22N2O2/c1-13-8-7-10-16(19-13)18(21)20(3)14(2)12-15-9-5-6-11-17(15)22-4/h5-11,14H,12H2,1-4H3/t14-/m1/s1
InChIKeyGJPVAWYTVFWVPC-CQSZACIVSA-N
MW298.39 g/mol
LogP3.10
Rot. Bonds5

About N-[(2R)-1-(2-methoxyphenyl)propan-2-yl]-N,6-dimethylpyridine-2-carboxamide

N-[(2R)-1-(2-methoxyphenyl)propan-2-yl]-N,6-dimethylpyridine-2-carboxamide (PubChem CID 96567463) has the molecular formula C18H22N2O2 and a molecular weight of 298.39 g/mol. Its IUPAC name is N-[(2R)-1-(2-methoxyphenyl)propan-2-yl]-N,6-dimethylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(2R)-1-(2-methoxyphenyl)propan-2-yl]-N,6-dimethylpyridine-2-carboxamide
PubChem CID96567463
Molecular FormulaC18H22N2O2
Molecular Weight298.39 g/mol
Exact Mass298.17
IUPAC NameN-[(2R)-1-(2-methoxyphenyl)propan-2-yl]-N,6-dimethylpyridine-2-carboxamide
SMILESCOc1ccccc1C[C@@H](C)N(C)C(=O)c1cccc(C)n1
InChIInChI=1S/C18H22N2O2/c1-13-8-7-10-16(19-13)18(21)20(3)14(2)12-15-9-5-6-11-17(15)22-4/h5-11,14H,12H2,1-4H3/t14-/m1/s1
InChIKeyGJPVAWYTVFWVPC-CQSZACIVSA-N
XLogP3.10
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(2-methoxyphenyl)propan-2-yl]-N,6-dimethylpyridine-2-carboxamide
CID 71994211
3-ethyl-1-[1-(2-methoxyphenyl)propan-2-yl]-1-methylurea
CID 71994436
N-(1-aminopropan-2-yl)-N,6-dimethylpyridine-2-carboxamide
CID 82507394
N-[(2R)-1-(2-methoxyphenyl)propan-2-yl]-N-methylquinoline-8-carboxamide
CID 96567455
N-[(2S)-1-(2-methoxyphenyl)propan-2-yl]-N,2-dimethyl-4-phenylpyrimidine-5-carboxamide
CID 99939494
5-[1-(2-methoxyphenyl)propan-2-yl-methylcarbamoyl]-4-methylpyridine-3-carboxylic acid
CID 146143174
1-[1-(2-methoxyphenyl)propan-2-yl]-1-methyl-3-propylurea
CID 115660984
methyl 2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]-2-oxoacetate
CID 112617368
2-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylacetamide;hydrochloride
CID 119319100
2-methoxy-N-[1-(2-methoxyphenyl)propan-2-yl]-N,2-dimethylpropanamide
CID 103029189
N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylpyrrolidine-1-carboxamide
CID 115665268
ethyl 2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]butanoate
CID 65486472

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-(2-methoxyphenyl)propan-2-yl]-N,6-dimethylpyridine-2-carboxamide?
The IUPAC name of N-[(2R)-1-(2-methoxyphenyl)propan-2-yl]-N,6-dimethylpyridine-2-carboxamide (CID 96567463) is N-[(2R)-1-(2-methoxyphenyl)propan-2-yl]-N,6-dimethylpyridine-2-carboxamide.
What is the SMILES notation for N-[(2R)-1-(2-methoxyphenyl)propan-2-yl]-N,6-dimethylpyridine-2-carboxamide?
The canonical SMILES for N-[(2R)-1-(2-methoxyphenyl)propan-2-yl]-N,6-dimethylpyridine-2-carboxamide is COc1ccccc1C[C@@H](C)N(C)C(=O)c1cccc(C)n1.
What is the InChIKey of N-[(2R)-1-(2-methoxyphenyl)propan-2-yl]-N,6-dimethylpyridine-2-carboxamide?
The InChIKey is GJPVAWYTVFWVPC-CQSZACIVSA-N. The full InChI is InChI=1S/C18H22N2O2/c1-13-8-7-10-16(19-13)18(21)20(3)14(2)12-15-9-5-6-11-17(15)22-4/h5-11,14H,12H2,1-4H3/t14-/m1/s1.
What are the key properties of N-[(2R)-1-(2-methoxyphenyl)propan-2-yl]-N,6-dimethylpyridine-2-carboxamide?
N-[(2R)-1-(2-methoxyphenyl)propan-2-yl]-N,6-dimethylpyridine-2-carboxamide has a molecular weight of 298.39 g/mol, XLogP of 3.10, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-(2-methoxyphenyl)propan-2-yl]-N,6-dimethylpyridine-2-carboxamide is sourced from PubChem (CID 96567463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).