N-(1-methylpyrazol-4-yl)-2-pyrazol-1-ylpropanamide

C10H13N5O — CID 47187700

IUPACN-(1-methylpyrazol-4-yl)-2-pyrazol-1-ylpropanamide
SMILESCC(C(=O)Nc1cnn(C)c1)n1cccn1
InChIInChI=1S/C10H13N5O/c1-8(15-5-3-4-11-15)10(16)13-9-6-12-14(2)7-9/h3-8H,1-2H3,(H,13,16)
InChIKeyFXMROBNTXCKQEE-UHFFFAOYSA-N
MW219.25 g/mol
LogP0.82
Rot. Bonds3

About N-(1-methylpyrazol-4-yl)-2-pyrazol-1-ylpropanamide

N-(1-methylpyrazol-4-yl)-2-pyrazol-1-ylpropanamide (PubChem CID 47187700) has the molecular formula C10H13N5O and a molecular weight of 219.25 g/mol. Its IUPAC name is N-(1-methylpyrazol-4-yl)-2-pyrazol-1-ylpropanamide.

Molecular Properties

Compound NameN-(1-methylpyrazol-4-yl)-2-pyrazol-1-ylpropanamide
PubChem CID47187700
Molecular FormulaC10H13N5O
Molecular Weight219.25 g/mol
Exact Mass219.11
IUPAC NameN-(1-methylpyrazol-4-yl)-2-pyrazol-1-ylpropanamide
SMILESCC(C(=O)Nc1cnn(C)c1)n1cccn1
InChIInChI=1S/C10H13N5O/c1-8(15-5-3-4-11-15)10(16)13-9-6-12-14(2)7-9/h3-8H,1-2H3,(H,13,16)
InChIKeyFXMROBNTXCKQEE-UHFFFAOYSA-N
XLogP0.82
TPSA64.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.25
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-phenyl-2-pyrazol-1-ylpropanamide
CID 42949018
ethane;2-methyl-N-(1-methylpyrazol-4-yl)propanamide
CID 178157560
N-(4-methylphenyl)-2-pyrazol-1-ylpropanamide
CID 134060372
N-[2-(4-methylpiperazin-1-yl)pyrimidin-5-yl]-2-pyrazol-1-ylpropanamide
CID 122299220
N-(3-acetamidophenyl)-2-pyrazol-1-ylpropanamide
CID 134060380
N-(6-amino-3-pyridinyl)-2-pyrazol-1-ylpropanamide
CID 55130465
N-[4-(4-methylpiperazin-1-yl)phenyl]-2-pyrazol-1-ylpropanamide
CID 134048457
N-(4-cyanophenyl)-2-pyrazol-1-ylpropanamide
CID 43187532
N-(4-bromo-3,5-dimethylphenyl)-2-pyrazol-1-ylpropanamide
CID 106491100
N-(6-chloro-5-methyl-3-pyridinyl)-2-pyrazol-1-ylpropanamide
CID 113250420
N-(2,6-dimethylphenyl)-2-pyrazol-1-ylpropanamide
CID 47156281
(2R)-N-[2,4-difluoro-5-[[(2S)-2-pyrazol-1-ylpropanoyl]amino]phenyl]-2-pyrazol-1-ylpropanamide
CID 97320876

Frequently Asked Questions

What is the IUPAC name of N-(1-methylpyrazol-4-yl)-2-pyrazol-1-ylpropanamide?
The IUPAC name of N-(1-methylpyrazol-4-yl)-2-pyrazol-1-ylpropanamide (CID 47187700) is N-(1-methylpyrazol-4-yl)-2-pyrazol-1-ylpropanamide.
What is the SMILES notation for N-(1-methylpyrazol-4-yl)-2-pyrazol-1-ylpropanamide?
The canonical SMILES for N-(1-methylpyrazol-4-yl)-2-pyrazol-1-ylpropanamide is CC(C(=O)Nc1cnn(C)c1)n1cccn1.
What is the InChIKey of N-(1-methylpyrazol-4-yl)-2-pyrazol-1-ylpropanamide?
The InChIKey is FXMROBNTXCKQEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5O/c1-8(15-5-3-4-11-15)10(16)13-9-6-12-14(2)7-9/h3-8H,1-2H3,(H,13,16).
What are the key properties of N-(1-methylpyrazol-4-yl)-2-pyrazol-1-ylpropanamide?
N-(1-methylpyrazol-4-yl)-2-pyrazol-1-ylpropanamide has a molecular weight of 219.25 g/mol, XLogP of 0.82, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylpyrazol-4-yl)-2-pyrazol-1-ylpropanamide is sourced from PubChem (CID 47187700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).