(2R)-2-imidazol-1-yl-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]propanamide

C15H23N5O — CID 126451829

IUPAC(2R)-2-imidazol-1-yl-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]propanamide
SMILESCC(C)CN(Cc1cnn(C)c1)C(=O)[C@@H](C)n1ccnc1
InChIInChI=1S/C15H23N5O/c1-12(2)8-20(10-14-7-17-18(4)9-14)15(21)13(3)19-6-5-16-11-19/h5-7,9,11-13H,8,10H2,1-4H3/t13-/m1/s1
InChIKeyKITLBLHEIWTLQI-CYBMUJFWSA-N
MW289.38 g/mol
LogP1.86
Rot. Bonds6

About (2R)-2-imidazol-1-yl-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]propanamide

(2R)-2-imidazol-1-yl-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]propanamide (PubChem CID 126451829) has the molecular formula C15H23N5O and a molecular weight of 289.38 g/mol. Its IUPAC name is (2R)-2-imidazol-1-yl-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]propanamide.

Molecular Properties

Compound Name(2R)-2-imidazol-1-yl-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]propanamide
PubChem CID126451829
Molecular FormulaC15H23N5O
Molecular Weight289.38 g/mol
Exact Mass289.19
IUPAC Name(2R)-2-imidazol-1-yl-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]propanamide
SMILESCC(C)CN(Cc1cnn(C)c1)C(=O)[C@@H](C)n1ccnc1
InChIInChI=1S/C15H23N5O/c1-12(2)8-20(10-14-7-17-18(4)9-14)15(21)13(3)19-6-5-16-11-19/h5-7,9,11-13H,8,10H2,1-4H3/t13-/m1/s1
InChIKeyKITLBLHEIWTLQI-CYBMUJFWSA-N
XLogP1.86
TPSA55.95 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]propanamide
CID 46998441
3-amino-N-ethyl-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]butanamide
CID 120503339
1-(2-methylpropyl)-1-[(1-methylpyrazol-4-yl)methyl]-3-[(3-pyrazol-1-ylphenyl)methyl]urea
CID 119071914
2-[2-methylpropyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide
CID 132968617
2-methyl-N-[(1-methylpyrazol-4-yl)methyl]-N-(pyridin-4-ylmethyl)propan-1-amine
CID 77096435
1-(2-methylpropyl)-1-[(1-methylpyrazol-4-yl)methyl]-3-[(1S)-1-phenyl-2-pyrazol-1-ylethyl]urea
CID 126433746
N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]-2-(4-oxo-3H-phthalazin-1-yl)acetamide
CID 146148048
(2R)-N-ethyl-2-imidazol-1-yl-N-[2-(methylamino)-2-oxoethyl]propanamide
CID 94456522
2-imidazol-1-yl-N-[(3-methylphenyl)methyl]-N-(pyridin-2-ylmethyl)propanamide
CID 56788413
N-ethyl-2-hydroxy-N-[(1-methylpyrazol-4-yl)methyl]-2-phenylacetamide
CID 111537345
(2S)-N-benzyl-N-[(2R)-butan-2-yl]-2-imidazol-1-ylpropanamide
CID 95617382
2-[(4R)-2,5-dioxo-1-propylimidazolidin-4-yl]-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]acetamide
CID 124752517

Frequently Asked Questions

What is the IUPAC name of (2R)-2-imidazol-1-yl-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]propanamide?
The IUPAC name of (2R)-2-imidazol-1-yl-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]propanamide (CID 126451829) is (2R)-2-imidazol-1-yl-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]propanamide.
What is the SMILES notation for (2R)-2-imidazol-1-yl-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]propanamide?
The canonical SMILES for (2R)-2-imidazol-1-yl-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]propanamide is CC(C)CN(Cc1cnn(C)c1)C(=O)[C@@H](C)n1ccnc1.
What is the InChIKey of (2R)-2-imidazol-1-yl-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]propanamide?
The InChIKey is KITLBLHEIWTLQI-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H23N5O/c1-12(2)8-20(10-14-7-17-18(4)9-14)15(21)13(3)19-6-5-16-11-19/h5-7,9,11-13H,8,10H2,1-4H3/t13-/m1/s1.
What are the key properties of (2R)-2-imidazol-1-yl-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]propanamide?
(2R)-2-imidazol-1-yl-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]propanamide has a molecular weight of 289.38 g/mol, XLogP of 1.86, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-imidazol-1-yl-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]propanamide is sourced from PubChem (CID 126451829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).