2-cyclopropyl-2-(cyclopropylamino)-3-pyrazol-1-ylpropanamide

C12H18N4O — CID 63920489

IUPAC2-cyclopropyl-2-(cyclopropylamino)-3-pyrazol-1-ylpropanamide
SMILESNC(=O)C(Cn1cccn1)(NC1CC1)C1CC1
InChIInChI=1S/C12H18N4O/c13-11(17)12(9-2-3-9,15-10-4-5-10)8-16-7-1-6-14-16/h1,6-7,9-10,15H,2-5,8H2,(H2,13,17)
InChIKeyMGEBSVVAQYUWGK-UHFFFAOYSA-N
MW234.30 g/mol
LogP0.27
Rot. Bonds6

About 2-cyclopropyl-2-(cyclopropylamino)-3-pyrazol-1-ylpropanamide

2-cyclopropyl-2-(cyclopropylamino)-3-pyrazol-1-ylpropanamide (PubChem CID 63920489) has the molecular formula C12H18N4O and a molecular weight of 234.30 g/mol. Its IUPAC name is 2-cyclopropyl-2-(cyclopropylamino)-3-pyrazol-1-ylpropanamide.

Molecular Properties

Compound Name2-cyclopropyl-2-(cyclopropylamino)-3-pyrazol-1-ylpropanamide
PubChem CID63920489
Molecular FormulaC12H18N4O
Molecular Weight234.30 g/mol
Exact Mass234.15
IUPAC Name2-cyclopropyl-2-(cyclopropylamino)-3-pyrazol-1-ylpropanamide
SMILESNC(=O)C(Cn1cccn1)(NC1CC1)C1CC1
InChIInChI=1S/C12H18N4O/c13-11(17)12(9-2-3-9,15-10-4-5-10)8-16-7-1-6-14-16/h1,6-7,9-10,15H,2-5,8H2,(H2,13,17)
InChIKeyMGEBSVVAQYUWGK-UHFFFAOYSA-N
XLogP0.27
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 50.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclopropyl-2-(cyclopropylamino)-3-(2-methylimidazol-1-yl)propanamide
CID 63919496
3-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-2-cyclopropyl-2-(cyclopropylamino)propanamide
CID 115561563
2-cyclopropyl-2-(cyclopropylamino)-3-(4-methylpiperidin-1-yl)propanamide
CID 63907004
3-(4-bromo-3,5-dimethylpyrazol-1-yl)-2-cyclopropyl-2-(cyclopropylamino)propanamide
CID 63920900
2-cyclopropyl-2-(cyclopropylamino)-3-(2-ethylpiperidin-1-yl)propanamide
CID 63909516
2-cyclopropyl-2-(cyclopropylamino)-3-(3-methoxypyrrolidin-1-yl)propanamide
CID 103537930
2-cyclopropyl-2-(cyclopropylamino)-3-phenylsulfanylpropanamide
CID 63916695
N-(1-amino-2-methyl-1-oxo-3-pyrazol-1-ylpropan-2-yl)cyclohexanecarboxamide
CID 138021907
3-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2-cyclopropyl-2-(cyclopropylamino)propanamide
CID 79932429
2-cyclopropyl-2-(cyclopropylamino)-3-[ethyl(propyl)amino]propanamide
CID 63911092
2-cyclopropyl-2-(cyclopropylamino)-3-[ethyl(propan-2-yl)amino]propanamide
CID 63911283
2-cyclopropyl-2-(ethylamino)-3-imidazol-1-ylpropanamide
CID 63920086

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-(cyclopropylamino)-3-pyrazol-1-ylpropanamide?
The IUPAC name of 2-cyclopropyl-2-(cyclopropylamino)-3-pyrazol-1-ylpropanamide (CID 63920489) is 2-cyclopropyl-2-(cyclopropylamino)-3-pyrazol-1-ylpropanamide.
What is the SMILES notation for 2-cyclopropyl-2-(cyclopropylamino)-3-pyrazol-1-ylpropanamide?
The canonical SMILES for 2-cyclopropyl-2-(cyclopropylamino)-3-pyrazol-1-ylpropanamide is NC(=O)C(Cn1cccn1)(NC1CC1)C1CC1.
What is the InChIKey of 2-cyclopropyl-2-(cyclopropylamino)-3-pyrazol-1-ylpropanamide?
The InChIKey is MGEBSVVAQYUWGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O/c13-11(17)12(9-2-3-9,15-10-4-5-10)8-16-7-1-6-14-16/h1,6-7,9-10,15H,2-5,8H2,(H2,13,17).
What are the key properties of 2-cyclopropyl-2-(cyclopropylamino)-3-pyrazol-1-ylpropanamide?
2-cyclopropyl-2-(cyclopropylamino)-3-pyrazol-1-ylpropanamide has a molecular weight of 234.30 g/mol, XLogP of 0.27, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-(cyclopropylamino)-3-pyrazol-1-ylpropanamide is sourced from PubChem (CID 63920489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).