3-methyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]furan-2-carboxamide

C12H15N3O2 — CID 38611766

IUPAC3-methyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]furan-2-carboxamide
SMILESCc1ccoc1C(=O)N[C@H](C)Cn1cccn1
InChIInChI=1S/C12H15N3O2/c1-9-4-7-17-11(9)12(16)14-10(2)8-15-6-3-5-13-15/h3-7,10H,8H2,1-2H3,(H,14,16)/t10-/m1/s1
InChIKeyBSEOXQHZUQPESZ-SNVBAGLBSA-N
MW233.27 g/mol
LogP1.60
Rot. Bonds4

About 3-methyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]furan-2-carboxamide

3-methyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]furan-2-carboxamide (PubChem CID 38611766) has the molecular formula C12H15N3O2 and a molecular weight of 233.27 g/mol. Its IUPAC name is 3-methyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]furan-2-carboxamide.

Molecular Properties

Compound Name3-methyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]furan-2-carboxamide
PubChem CID38611766
Molecular FormulaC12H15N3O2
Molecular Weight233.27 g/mol
Exact Mass233.12
IUPAC Name3-methyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]furan-2-carboxamide
SMILESCc1ccoc1C(=O)N[C@H](C)Cn1cccn1
InChIInChI=1S/C12H15N3O2/c1-9-4-7-17-11(9)12(16)14-10(2)8-15-6-3-5-13-15/h3-7,10H,8H2,1-2H3,(H,14,16)/t10-/m1/s1
InChIKeyBSEOXQHZUQPESZ-SNVBAGLBSA-N
XLogP1.60
TPSA60.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-methyl-N-(1-pyrazol-1-ylpropan-2-yl)furan-2-carboxamide
CID 51079611
2-amino-6-methyl-N-(1-pyrazol-1-ylpropan-2-yl)benzamide
CID 61459501
2-[5-(1-pyrazol-1-ylpropan-2-ylcarbamoyl)pyrazol-1-yl]propanoic acid
CID 19487864
2-(1-pyrazol-1-ylpropan-2-ylcarbamoyl)benzoic acid
CID 60940603
5-bromo-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]furan-2-carboxamide
CID 38608481
3,5-dihydroxy-N-(1-pyrazol-1-ylpropan-2-yl)benzamide
CID 103891981
4-(aminomethyl)-N-(1-pyrazol-1-ylpropan-2-yl)benzamide
CID 43695373
2-(aminomethyl)-N-(1-pyrazol-1-ylpropan-2-yl)pyridine-4-carboxamide
CID 114325720
2-(ethylamino)-N-(1-pyrazol-1-ylpropan-2-yl)benzamide
CID 62178733
2-fluoro-6-hydroxy-N-(1-pyrazol-1-ylpropan-2-yl)benzamide
CID 104916779
N-[(1R)-2-imidazol-1-yl-1-phenylethyl]-3-methylfuran-2-carboxamide
CID 95197180
1-(4-methylphenyl)-3-[(2R)-1-pyrazol-1-ylpropan-2-yl]urea
CID 94116600

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]furan-2-carboxamide?
The IUPAC name of 3-methyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]furan-2-carboxamide (CID 38611766) is 3-methyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]furan-2-carboxamide.
What is the SMILES notation for 3-methyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]furan-2-carboxamide?
The canonical SMILES for 3-methyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]furan-2-carboxamide is Cc1ccoc1C(=O)N[C@H](C)Cn1cccn1.
What is the InChIKey of 3-methyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]furan-2-carboxamide?
The InChIKey is BSEOXQHZUQPESZ-SNVBAGLBSA-N. The full InChI is InChI=1S/C12H15N3O2/c1-9-4-7-17-11(9)12(16)14-10(2)8-15-6-3-5-13-15/h3-7,10H,8H2,1-2H3,(H,14,16)/t10-/m1/s1.
What are the key properties of 3-methyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]furan-2-carboxamide?
3-methyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]furan-2-carboxamide has a molecular weight of 233.27 g/mol, XLogP of 1.60, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]furan-2-carboxamide is sourced from PubChem (CID 38611766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).