N-[(2R)-1-imidazol-1-ylpropan-2-yl]-4-(4-methoxyphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide

C19H24N4O2 — CID 94122847

IUPACN-[(2R)-1-imidazol-1-ylpropan-2-yl]-4-(4-methoxyphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide
SMILESCOc1ccc(C2=CCN(C(=O)N[C@H](C)Cn3ccnc3)CC2)cc1
InChIInChI=1S/C19H24N4O2/c1-15(13-22-12-9-20-14-22)21-19(24)23-10-7-17(8-11-23)16-3-5-18(25-2)6-4-16/h3-7,9,12,14-15H,8,10-11,13H2,1-2H3,(H,21,24)/t15-/m1/s1
InChIKeyTTWMULKPPSTCJE-OAHLLOKOSA-N
MW340.43 g/mol
LogP2.78
Rot. Bonds5

About N-[(2R)-1-imidazol-1-ylpropan-2-yl]-4-(4-methoxyphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide

N-[(2R)-1-imidazol-1-ylpropan-2-yl]-4-(4-methoxyphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide (PubChem CID 94122847) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is N-[(2R)-1-imidazol-1-ylpropan-2-yl]-4-(4-methoxyphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide.

Molecular Properties

Compound NameN-[(2R)-1-imidazol-1-ylpropan-2-yl]-4-(4-methoxyphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide
PubChem CID94122847
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC NameN-[(2R)-1-imidazol-1-ylpropan-2-yl]-4-(4-methoxyphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide
SMILESCOc1ccc(C2=CCN(C(=O)N[C@H](C)Cn3ccnc3)CC2)cc1
InChIInChI=1S/C19H24N4O2/c1-15(13-22-12-9-20-14-22)21-19(24)23-10-7-17(8-11-23)16-3-5-18(25-2)6-4-16/h3-7,9,12,14-15H,8,10-11,13H2,1-2H3,(H,21,24)/t15-/m1/s1
InChIKeyTTWMULKPPSTCJE-OAHLLOKOSA-N
XLogP2.78
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2R)-1-imidazol-1-ylpropan-2-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
CID 94122779
1-[4-(4-methoxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]propan-1-one
CID 142929013
N-[(2S)-1-imidazol-1-ylpropan-2-yl]thiomorpholine-4-carboxamide
CID 94122810
N-[(2R)-1-imidazol-1-ylpropan-2-yl]-4-(pyridin-4-ylmethyl)piperazine-1-carboxamide
CID 95152739
1-[(2R)-2-(dimethylamino)-2-(4-methoxyphenyl)ethyl]-3-[(2R)-1-imidazol-1-ylpropan-2-yl]urea
CID 94871793
4-(4-methoxyphenyl)-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]piperazine-1-carboxamide
CID 95126839
(2R,6S)-N-[(2R)-1-imidazol-1-ylpropan-2-yl]-2,6-dimethylmorpholine-4-carboxamide
CID 100561408
(2S)-1-[4-(4-methoxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]-2-methylsulfonylpropan-1-one
CID 94029523
N-[(2R)-1-imidazol-1-ylpropan-2-yl]-4-pyrazin-2-ylpiperazine-1-carboxamide
CID 94122773
N-[(2S)-1-imidazol-1-ylpropan-2-yl]-4-(thiophen-3-ylmethyl)piperazine-1-carboxamide
CID 95127355
methyl N-[4-[[(2S)-1-imidazol-1-ylpropan-2-yl]carbamoylamino]phenyl]carbamate
CID 95574102
1-[(2S)-1-imidazol-1-yl-3,3-dimethylbutan-2-yl]-3-(4-methoxyphenyl)urea
CID 93233544

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-imidazol-1-ylpropan-2-yl]-4-(4-methoxyphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide?
The IUPAC name of N-[(2R)-1-imidazol-1-ylpropan-2-yl]-4-(4-methoxyphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide (CID 94122847) is N-[(2R)-1-imidazol-1-ylpropan-2-yl]-4-(4-methoxyphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide.
What is the SMILES notation for N-[(2R)-1-imidazol-1-ylpropan-2-yl]-4-(4-methoxyphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide?
The canonical SMILES for N-[(2R)-1-imidazol-1-ylpropan-2-yl]-4-(4-methoxyphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide is COc1ccc(C2=CCN(C(=O)N[C@H](C)Cn3ccnc3)CC2)cc1.
What is the InChIKey of N-[(2R)-1-imidazol-1-ylpropan-2-yl]-4-(4-methoxyphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide?
The InChIKey is TTWMULKPPSTCJE-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-15(13-22-12-9-20-14-22)21-19(24)23-10-7-17(8-11-23)16-3-5-18(25-2)6-4-16/h3-7,9,12,14-15H,8,10-11,13H2,1-2H3,(H,21,24)/t15-/m1/s1.
What are the key properties of N-[(2R)-1-imidazol-1-ylpropan-2-yl]-4-(4-methoxyphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide?
N-[(2R)-1-imidazol-1-ylpropan-2-yl]-4-(4-methoxyphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide has a molecular weight of 340.43 g/mol, XLogP of 2.78, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-imidazol-1-ylpropan-2-yl]-4-(4-methoxyphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide is sourced from PubChem (CID 94122847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).