N-[(2R)-1-(dimethylamino)-3-phenylpropan-2-yl]-1-methyl-6-oxopyridine-3-carboxamide

C18H23N3O2 — CID 97313866

IUPACN-[(2R)-1-(dimethylamino)-3-phenylpropan-2-yl]-1-methyl-6-oxopyridine-3-carboxamide
SMILESCN(C)C[C@@H](Cc1ccccc1)NC(=O)c1ccc(=O)n(C)c1
InChIInChI=1S/C18H23N3O2/c1-20(2)13-16(11-14-7-5-4-6-8-14)19-18(23)15-9-10-17(22)21(3)12-15/h4-10,12,16H,11,13H2,1-3H3,(H,19,23)/t16-/m1/s1
InChIKeyYDIVMAWAJNJGFB-MRXNPFEDSA-N
MW313.40 g/mol
LogP1.29
Rot. Bonds6

About N-[(2R)-1-(dimethylamino)-3-phenylpropan-2-yl]-1-methyl-6-oxopyridine-3-carboxamide

N-[(2R)-1-(dimethylamino)-3-phenylpropan-2-yl]-1-methyl-6-oxopyridine-3-carboxamide (PubChem CID 97313866) has the molecular formula C18H23N3O2 and a molecular weight of 313.40 g/mol. Its IUPAC name is N-[(2R)-1-(dimethylamino)-3-phenylpropan-2-yl]-1-methyl-6-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(2R)-1-(dimethylamino)-3-phenylpropan-2-yl]-1-methyl-6-oxopyridine-3-carboxamide
PubChem CID97313866
Molecular FormulaC18H23N3O2
Molecular Weight313.40 g/mol
Exact Mass313.18
IUPAC NameN-[(2R)-1-(dimethylamino)-3-phenylpropan-2-yl]-1-methyl-6-oxopyridine-3-carboxamide
SMILESCN(C)C[C@@H](Cc1ccccc1)NC(=O)c1ccc(=O)n(C)c1
InChIInChI=1S/C18H23N3O2/c1-20(2)13-16(11-14-7-5-4-6-8-14)19-18(23)15-9-10-17(22)21(3)12-15/h4-10,12,16H,11,13H2,1-3H3,(H,19,23)/t16-/m1/s1
InChIKeyYDIVMAWAJNJGFB-MRXNPFEDSA-N
XLogP1.29
TPSA54.34 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2S)-1-(dimethylamino)-3-phenylpropan-2-yl]-1-methyl-2-oxopyridine-4-carboxamide
CID 97313597
4-amino-N-[1-(dimethylamino)-3-phenylpropan-2-yl]benzamide;hydrochloride
CID 117067649
1-[(2S)-1-(dimethylamino)-3-phenylpropan-2-yl]-3-[(2R)-1-(dimethylamino)-3-phenylpropan-2-yl]urea
CID 124628915
1,3-bis[(2R)-1-(dimethylamino)-3-phenylpropan-2-yl]urea
CID 124628917
N-[1-(dimethylamino)-3-phenylpropan-2-yl]-2,2-dimethylpropanamide
CID 146198443
(3S)-N-[(2R)-1-(dimethylamino)-3-phenylpropan-2-yl]-1-methyl-5-oxopyrrolidine-3-carboxamide
CID 95291646
tert-butyl N-[(2S)-1-(dimethylamino)-3-phenylpropan-2-yl]carbamate
CID 142063959
1-methyl-5-(1-phenylbutan-2-ylamino)pyridin-2-one
CID 79007599
N-[(2S)-1-phenylbutan-2-yl]benzamide
CID 778631
1-[1-(dimethylamino)-3-phenylpropan-2-yl]-3-[(4-fluorophenyl)methyl]urea
CID 60544381
1-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-(1-methyl-6-oxo-3-pyridinyl)urea
CID 97314632
N-[1-(dimethylamino)-3-phenylpropan-2-yl]-3-methylpiperidine-1-carboxamide
CID 60547159

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-(dimethylamino)-3-phenylpropan-2-yl]-1-methyl-6-oxopyridine-3-carboxamide?
The IUPAC name of N-[(2R)-1-(dimethylamino)-3-phenylpropan-2-yl]-1-methyl-6-oxopyridine-3-carboxamide (CID 97313866) is N-[(2R)-1-(dimethylamino)-3-phenylpropan-2-yl]-1-methyl-6-oxopyridine-3-carboxamide.
What is the SMILES notation for N-[(2R)-1-(dimethylamino)-3-phenylpropan-2-yl]-1-methyl-6-oxopyridine-3-carboxamide?
The canonical SMILES for N-[(2R)-1-(dimethylamino)-3-phenylpropan-2-yl]-1-methyl-6-oxopyridine-3-carboxamide is CN(C)C[C@@H](Cc1ccccc1)NC(=O)c1ccc(=O)n(C)c1.
What is the InChIKey of N-[(2R)-1-(dimethylamino)-3-phenylpropan-2-yl]-1-methyl-6-oxopyridine-3-carboxamide?
The InChIKey is YDIVMAWAJNJGFB-MRXNPFEDSA-N. The full InChI is InChI=1S/C18H23N3O2/c1-20(2)13-16(11-14-7-5-4-6-8-14)19-18(23)15-9-10-17(22)21(3)12-15/h4-10,12,16H,11,13H2,1-3H3,(H,19,23)/t16-/m1/s1.
What are the key properties of N-[(2R)-1-(dimethylamino)-3-phenylpropan-2-yl]-1-methyl-6-oxopyridine-3-carboxamide?
N-[(2R)-1-(dimethylamino)-3-phenylpropan-2-yl]-1-methyl-6-oxopyridine-3-carboxamide has a molecular weight of 313.40 g/mol, XLogP of 1.29, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-(dimethylamino)-3-phenylpropan-2-yl]-1-methyl-6-oxopyridine-3-carboxamide is sourced from PubChem (CID 97313866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).