N-(furan-2-ylmethyl)-2-(4-methylpyrazol-1-yl)propanamide

C12H15N3O2 — CID 19534412

IUPACN-(furan-2-ylmethyl)-2-(4-methylpyrazol-1-yl)propanamide
SMILESCc1cnn(C(C)C(=O)NCc2ccco2)c1
InChIInChI=1S/C12H15N3O2/c1-9-6-14-15(8-9)10(2)12(16)13-7-11-4-3-5-17-11/h3-6,8,10H,7H2,1-2H3,(H,13,16)
InChIKeyRAUCRQPGFISXHB-UHFFFAOYSA-N
MW233.27 g/mol
LogP1.66
Rot. Bonds4

About N-(furan-2-ylmethyl)-2-(4-methylpyrazol-1-yl)propanamide

N-(furan-2-ylmethyl)-2-(4-methylpyrazol-1-yl)propanamide (PubChem CID 19534412) has the molecular formula C12H15N3O2 and a molecular weight of 233.27 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2-(4-methylpyrazol-1-yl)propanamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2-(4-methylpyrazol-1-yl)propanamide
PubChem CID19534412
Molecular FormulaC12H15N3O2
Molecular Weight233.27 g/mol
Exact Mass233.12
IUPAC NameN-(furan-2-ylmethyl)-2-(4-methylpyrazol-1-yl)propanamide
SMILESCc1cnn(C(C)C(=O)NCc2ccco2)c1
InChIInChI=1S/C12H15N3O2/c1-9-6-14-15(8-9)10(2)12(16)13-7-11-4-3-5-17-11/h3-6,8,10H,7H2,1-2H3,(H,13,16)
InChIKeyRAUCRQPGFISXHB-UHFFFAOYSA-N
XLogP1.66
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 ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(furan-2-ylmethyl)-2-(4-phenylpyrazol-1-yl)propanamide
CID 110210706
N-(furan-2-ylmethyl)-2-(4-nitropyrazol-1-yl)propanamide
CID 4918403
2-(4-chloropyrazol-1-yl)-N-(furan-2-ylmethyl)butanamide
CID 19536831
1-[4-(furan-2-ylmethyl)piperazin-1-yl]-2-(4-methylpyrazol-1-yl)propan-1-one
CID 19536190
(2S)-N-(furan-2-ylmethyl)-1-(4-methylpyrazol-1-yl)propan-2-amine
CID 95290591
(2R)-N-(furan-2-ylmethyl)-2-hydroxypropanamide
CID 93242884
2-[4-[[5-(furan-2-ylmethylcarbamoyl)-1-methylpyrazol-4-yl]carbamoyl]pyrazol-1-yl]propanoic acid
CID 19504711
(2R)-2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)-N-(furan-2-ylmethyl)propanamide
CID 1259182
2-(4-chloro-2-methyl-6-oxopyrimidin-1-yl)-N-(furan-2-ylmethyl)propanamide
CID 114581661
2-[(3R)-3-aminopyrrolidin-1-yl]-N-(furan-2-ylmethyl)propanamide
CID 115301891
N-(furan-2-ylmethyl)-2-(propan-2-ylamino)pyrimidine-5-carboxamide
CID 109247083
N-(furan-2-ylmethyl)-2-[(4-methylphenyl)methylamino]propanamide
CID 43084593

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2-(4-methylpyrazol-1-yl)propanamide?
The IUPAC name of N-(furan-2-ylmethyl)-2-(4-methylpyrazol-1-yl)propanamide (CID 19534412) is N-(furan-2-ylmethyl)-2-(4-methylpyrazol-1-yl)propanamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-2-(4-methylpyrazol-1-yl)propanamide?
The canonical SMILES for N-(furan-2-ylmethyl)-2-(4-methylpyrazol-1-yl)propanamide is Cc1cnn(C(C)C(=O)NCc2ccco2)c1.
What is the InChIKey of N-(furan-2-ylmethyl)-2-(4-methylpyrazol-1-yl)propanamide?
The InChIKey is RAUCRQPGFISXHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O2/c1-9-6-14-15(8-9)10(2)12(16)13-7-11-4-3-5-17-11/h3-6,8,10H,7H2,1-2H3,(H,13,16).
What are the key properties of N-(furan-2-ylmethyl)-2-(4-methylpyrazol-1-yl)propanamide?
N-(furan-2-ylmethyl)-2-(4-methylpyrazol-1-yl)propanamide has a molecular weight of 233.27 g/mol, XLogP of 1.66, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-2-(4-methylpyrazol-1-yl)propanamide is sourced from PubChem (CID 19534412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).