(5R)-N-[(1-methylpyrazol-4-yl)methyl]-N,3-di(propan-2-yl)-4,5-dihydro-1,2-oxazole-5-carboxamide

C15H24N4O2 — CID 95200317

IUPAC(5R)-N-[(1-methylpyrazol-4-yl)methyl]-N,3-di(propan-2-yl)-4,5-dihydro-1,2-oxazole-5-carboxamide
SMILESCC(C)C1=NO[C@@H](C(=O)N(Cc2cnn(C)c2)C(C)C)C1
InChIInChI=1S/C15H24N4O2/c1-10(2)13-6-14(21-17-13)15(20)19(11(3)4)9-12-7-16-18(5)8-12/h7-8,10-11,14H,6,9H2,1-5H3/t14-/m1/s1
InChIKeyHRPYNOSDAHBMKG-CQSZACIVSA-N
MW292.38 g/mol
LogP1.96
Rot. Bonds5

About (5R)-N-[(1-methylpyrazol-4-yl)methyl]-N,3-di(propan-2-yl)-4,5-dihydro-1,2-oxazole-5-carboxamide

(5R)-N-[(1-methylpyrazol-4-yl)methyl]-N,3-di(propan-2-yl)-4,5-dihydro-1,2-oxazole-5-carboxamide (PubChem CID 95200317) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is (5R)-N-[(1-methylpyrazol-4-yl)methyl]-N,3-di(propan-2-yl)-4,5-dihydro-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound Name(5R)-N-[(1-methylpyrazol-4-yl)methyl]-N,3-di(propan-2-yl)-4,5-dihydro-1,2-oxazole-5-carboxamide
PubChem CID95200317
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Name(5R)-N-[(1-methylpyrazol-4-yl)methyl]-N,3-di(propan-2-yl)-4,5-dihydro-1,2-oxazole-5-carboxamide
SMILESCC(C)C1=NO[C@@H](C(=O)N(Cc2cnn(C)c2)C(C)C)C1
InChIInChI=1S/C15H24N4O2/c1-10(2)13-6-14(21-17-13)15(20)19(11(3)4)9-12-7-16-18(5)8-12/h7-8,10-11,14H,6,9H2,1-5H3/t14-/m1/s1
InChIKeyHRPYNOSDAHBMKG-CQSZACIVSA-N
XLogP1.96
TPSA59.72 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

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2-(3-methyl-1,2-oxazol-5-yl)-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylacetamide
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N-[(1-methylpyrazol-4-yl)methyl]-4-oxo-4-phenyl-N-propan-2-ylbutanamide
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3-methyl-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide
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(5R)-N-methyl-3-propan-2-yl-N-[(4-propan-2-yl-1,2,4-triazol-3-yl)methyl]-4,5-dihydro-1,2-oxazole-5-carboxamide
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2-(2-bromo-4,5-diethoxyphenyl)-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylacetamide
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tert-butyl N-[2-[(1-methylpyrazol-4-yl)methylamino]ethyl]-N-propan-2-ylcarbamate
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(3S,4R)-1-methyl-3-[[(1-methylpyrazol-4-yl)methyl-propan-2-ylamino]methyl]piperidin-4-ol
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5-[1-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]ethyl]furan-2-carboxylic acid
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Frequently Asked Questions

What is the IUPAC name of (5R)-N-[(1-methylpyrazol-4-yl)methyl]-N,3-di(propan-2-yl)-4,5-dihydro-1,2-oxazole-5-carboxamide?
The IUPAC name of (5R)-N-[(1-methylpyrazol-4-yl)methyl]-N,3-di(propan-2-yl)-4,5-dihydro-1,2-oxazole-5-carboxamide (CID 95200317) is (5R)-N-[(1-methylpyrazol-4-yl)methyl]-N,3-di(propan-2-yl)-4,5-dihydro-1,2-oxazole-5-carboxamide.
What is the SMILES notation for (5R)-N-[(1-methylpyrazol-4-yl)methyl]-N,3-di(propan-2-yl)-4,5-dihydro-1,2-oxazole-5-carboxamide?
The canonical SMILES for (5R)-N-[(1-methylpyrazol-4-yl)methyl]-N,3-di(propan-2-yl)-4,5-dihydro-1,2-oxazole-5-carboxamide is CC(C)C1=NO[C@@H](C(=O)N(Cc2cnn(C)c2)C(C)C)C1.
What is the InChIKey of (5R)-N-[(1-methylpyrazol-4-yl)methyl]-N,3-di(propan-2-yl)-4,5-dihydro-1,2-oxazole-5-carboxamide?
The InChIKey is HRPYNOSDAHBMKG-CQSZACIVSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-10(2)13-6-14(21-17-13)15(20)19(11(3)4)9-12-7-16-18(5)8-12/h7-8,10-11,14H,6,9H2,1-5H3/t14-/m1/s1.
What are the key properties of (5R)-N-[(1-methylpyrazol-4-yl)methyl]-N,3-di(propan-2-yl)-4,5-dihydro-1,2-oxazole-5-carboxamide?
(5R)-N-[(1-methylpyrazol-4-yl)methyl]-N,3-di(propan-2-yl)-4,5-dihydro-1,2-oxazole-5-carboxamide has a molecular weight of 292.38 g/mol, XLogP of 1.96, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-N-[(1-methylpyrazol-4-yl)methyl]-N,3-di(propan-2-yl)-4,5-dihydro-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 95200317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).