5-cyclopropyl-1-methyl-N-(2-methylprop-2-enyl)pyrazol-4-amine

C11H17N3 — CID 130685297

IUPAC5-cyclopropyl-1-methyl-N-(2-methylprop-2-enyl)pyrazol-4-amine
SMILESC=C(C)CNc1cnn(C)c1C1CC1
InChIInChI=1S/C11H17N3/c1-8(2)6-12-10-7-13-14(3)11(10)9-4-5-9/h7,9,12H,1,4-6H2,2-3H3
InChIKeyRQXKXHLWQPAUGZ-UHFFFAOYSA-N
MW191.28 g/mol
LogP2.29
Rot. Bonds4

About 5-cyclopropyl-1-methyl-N-(2-methylprop-2-enyl)pyrazol-4-amine

5-cyclopropyl-1-methyl-N-(2-methylprop-2-enyl)pyrazol-4-amine (PubChem CID 130685297) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 5-cyclopropyl-1-methyl-N-(2-methylprop-2-enyl)pyrazol-4-amine.

Molecular Properties

Compound Name5-cyclopropyl-1-methyl-N-(2-methylprop-2-enyl)pyrazol-4-amine
PubChem CID130685297
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name5-cyclopropyl-1-methyl-N-(2-methylprop-2-enyl)pyrazol-4-amine
SMILESC=C(C)CNc1cnn(C)c1C1CC1
InChIInChI=1S/C11H17N3/c1-8(2)6-12-10-7-13-14(3)11(10)9-4-5-9/h7,9,12H,1,4-6H2,2-3H3
InChIKeyRQXKXHLWQPAUGZ-UHFFFAOYSA-N
XLogP2.29
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-but-3-ynyl-5-cyclopropyl-1-methylpyrazol-4-amine
CID 130695754
5-cyclopropyl-N-(3-ethoxypropyl)-1-methylpyrazol-4-amine
CID 166295119
(5-cyclopropyl-1-methylpyrazol-4-yl)methanamine;dihydrochloride
CID 171340448
1-methyl-N-(2-methylprop-2-enyl)pyrazol-4-amine
CID 79771007
2-(5-cyclopropyl-1-methylpyrazol-4-yl)ethanamine
CID 83826863
3-(5-cyclopropyl-1-methylpyrazol-4-yl)propanoic acid
CID 83830722
5-cyclopropyl-1-methyl-4-(trifluoromethyl)pyrazole
CID 150394513
5-cyclohexyl-1-methylpyrazol-4-ol
CID 105438932
3-(4-chloro-1-methylpyrazol-5-yl)-N-ethylcyclopentan-1-amine
CID 114664100
6-chloro-2-cyclopropyl-N-(2-methylprop-2-enyl)pyrimidin-4-amine
CID 104952861
4-[(5-cyclopropyl-1-methylpyrazole-4-carbonyl)amino]butanoic acid
CID 119352510
2-cyclopropyl-N-(1,5-dimethylpyrazol-4-yl)pyridine-3-carboxamide
CID 127824011

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-1-methyl-N-(2-methylprop-2-enyl)pyrazol-4-amine?
The IUPAC name of 5-cyclopropyl-1-methyl-N-(2-methylprop-2-enyl)pyrazol-4-amine (CID 130685297) is 5-cyclopropyl-1-methyl-N-(2-methylprop-2-enyl)pyrazol-4-amine.
What is the SMILES notation for 5-cyclopropyl-1-methyl-N-(2-methylprop-2-enyl)pyrazol-4-amine?
The canonical SMILES for 5-cyclopropyl-1-methyl-N-(2-methylprop-2-enyl)pyrazol-4-amine is C=C(C)CNc1cnn(C)c1C1CC1.
What is the InChIKey of 5-cyclopropyl-1-methyl-N-(2-methylprop-2-enyl)pyrazol-4-amine?
The InChIKey is RQXKXHLWQPAUGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-8(2)6-12-10-7-13-14(3)11(10)9-4-5-9/h7,9,12H,1,4-6H2,2-3H3.
What are the key properties of 5-cyclopropyl-1-methyl-N-(2-methylprop-2-enyl)pyrazol-4-amine?
5-cyclopropyl-1-methyl-N-(2-methylprop-2-enyl)pyrazol-4-amine has a molecular weight of 191.28 g/mol, XLogP of 2.29, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-1-methyl-N-(2-methylprop-2-enyl)pyrazol-4-amine is sourced from PubChem (CID 130685297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).