(2R)-2-imidazol-1-yl-N-methyl-N-[(2S)-1-pyridin-2-ylpropan-2-yl]propanamide

C15H20N4O — CID 51591899

IUPAC(2R)-2-imidazol-1-yl-N-methyl-N-[(2S)-1-pyridin-2-ylpropan-2-yl]propanamide
SMILESC[C@H](C(=O)N(C)[C@@H](C)Cc1ccccn1)n1ccnc1
InChIInChI=1S/C15H20N4O/c1-12(10-14-6-4-5-7-17-14)18(3)15(20)13(2)19-9-8-16-11-19/h4-9,11-13H,10H2,1-3H3/t12-,13+/m0/s1
InChIKeyGAOZHBIRPMGNLE-QWHCGFSZSA-N
MW272.35 g/mol
LogP1.93
Rot. Bonds5

About (2R)-2-imidazol-1-yl-N-methyl-N-[(2S)-1-pyridin-2-ylpropan-2-yl]propanamide

(2R)-2-imidazol-1-yl-N-methyl-N-[(2S)-1-pyridin-2-ylpropan-2-yl]propanamide (PubChem CID 51591899) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is (2R)-2-imidazol-1-yl-N-methyl-N-[(2S)-1-pyridin-2-ylpropan-2-yl]propanamide.

Molecular Properties

Compound Name(2R)-2-imidazol-1-yl-N-methyl-N-[(2S)-1-pyridin-2-ylpropan-2-yl]propanamide
PubChem CID51591899
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name(2R)-2-imidazol-1-yl-N-methyl-N-[(2S)-1-pyridin-2-ylpropan-2-yl]propanamide
SMILESC[C@H](C(=O)N(C)[C@@H](C)Cc1ccccn1)n1ccnc1
InChIInChI=1S/C15H20N4O/c1-12(10-14-6-4-5-7-17-14)18(3)15(20)13(2)19-9-8-16-11-19/h4-9,11-13H,10H2,1-3H3/t12-,13+/m0/s1
InChIKeyGAOZHBIRPMGNLE-QWHCGFSZSA-N
XLogP1.93
TPSA51.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 51.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-imidazol-1-yl-N-methyl-N-[(2S)-1-pyridin-2-ylpropan-2-yl]propanamide?
The IUPAC name of (2R)-2-imidazol-1-yl-N-methyl-N-[(2S)-1-pyridin-2-ylpropan-2-yl]propanamide (CID 51591899) is (2R)-2-imidazol-1-yl-N-methyl-N-[(2S)-1-pyridin-2-ylpropan-2-yl]propanamide.
What is the SMILES notation for (2R)-2-imidazol-1-yl-N-methyl-N-[(2S)-1-pyridin-2-ylpropan-2-yl]propanamide?
The canonical SMILES for (2R)-2-imidazol-1-yl-N-methyl-N-[(2S)-1-pyridin-2-ylpropan-2-yl]propanamide is C[C@H](C(=O)N(C)[C@@H](C)Cc1ccccn1)n1ccnc1.
What is the InChIKey of (2R)-2-imidazol-1-yl-N-methyl-N-[(2S)-1-pyridin-2-ylpropan-2-yl]propanamide?
The InChIKey is GAOZHBIRPMGNLE-QWHCGFSZSA-N. The full InChI is InChI=1S/C15H20N4O/c1-12(10-14-6-4-5-7-17-14)18(3)15(20)13(2)19-9-8-16-11-19/h4-9,11-13H,10H2,1-3H3/t12-,13+/m0/s1.
What are the key properties of (2R)-2-imidazol-1-yl-N-methyl-N-[(2S)-1-pyridin-2-ylpropan-2-yl]propanamide?
(2R)-2-imidazol-1-yl-N-methyl-N-[(2S)-1-pyridin-2-ylpropan-2-yl]propanamide has a molecular weight of 272.35 g/mol, XLogP of 1.93, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-imidazol-1-yl-N-methyl-N-[(2S)-1-pyridin-2-ylpropan-2-yl]propanamide is sourced from PubChem (CID 51591899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).