1-methyl-4-pent-1-enylpyrazol-5-amine

C9H15N3 — CID 123377825

IUPAC1-methyl-4-pent-1-enylpyrazol-5-amine
SMILESCCCC=Cc1cnn(C)c1N
InChIInChI=1S/C9H15N3/c1-3-4-5-6-8-7-11-12(2)9(8)10/h5-7H,3-4,10H2,1-2H3
InChIKeyIGWAFPQFLFOFGS-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.82
Rot. Bonds3

About 1-methyl-4-pent-1-enylpyrazol-5-amine

1-methyl-4-pent-1-enylpyrazol-5-amine (PubChem CID 123377825) has the molecular formula C9H15N3 and a molecular weight of 165.24 g/mol. Its IUPAC name is 1-methyl-4-pent-1-enylpyrazol-5-amine.

Molecular Properties

Compound Name1-methyl-4-pent-1-enylpyrazol-5-amine
PubChem CID123377825
Molecular FormulaC9H15N3
Molecular Weight165.24 g/mol
Exact Mass165.13
IUPAC Name1-methyl-4-pent-1-enylpyrazol-5-amine
SMILESCCCC=Cc1cnn(C)c1N
InChIInChI=1S/C9H15N3/c1-3-4-5-6-8-7-11-12(2)9(8)10/h5-7H,3-4,10H2,1-2H3
InChIKeyIGWAFPQFLFOFGS-UHFFFAOYSA-N
XLogP1.82
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-diethyl-4-[(1E,3Z)-3-(1-fluoroethyl)-2-methylhexa-1,3,5-trienyl]-1-methylpyrazol-3-amine
CID 166689126
6-(5-amino-1-methylpyrazol-4-yl)-1H-pyrimidine-4-thione
CID 67989264
4-Cyclohexa-1,3-dien-1-yl-1-methylpyrazol-5-amine
CID 90169153
4-[(E)-but-1-enyl]-1-methylpyrazole
CID 121278060
1-[2-Ethenyl-4-(1-ethylpyrazol-4-yl)hexa-2,4-dienyl]-4-methylpyrazol-5-amine
CID 123278088
1-methyl-6H-pyrazolo[5,4-b]azepine
CID 123366036
4-ethenyl-N,1-dimethylpyrazol-5-amine
CID 123431681
1,8-dimethyl-6H-pyrazolo[5,4-b]azepin-8-ium
CID 123999754
4-Ethenyl-1-methylpyrazol-3-amine
CID 124003987
1-methyl-4-[(E)-pent-1-enyl]pyrazole
CID 125476247
4-ethyl-1-[(1Z,3Z)-penta-1,3-dienyl]pyrazol-5-amine
CID 132171439
(E)-N-methyl-3-(1-methylpyrazol-4-yl)prop-2-en-1-amine
CID 135343059

Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-pent-1-enylpyrazol-5-amine?
The IUPAC name of 1-methyl-4-pent-1-enylpyrazol-5-amine (CID 123377825) is 1-methyl-4-pent-1-enylpyrazol-5-amine.
What is the SMILES notation for 1-methyl-4-pent-1-enylpyrazol-5-amine?
The canonical SMILES for 1-methyl-4-pent-1-enylpyrazol-5-amine is CCCC=Cc1cnn(C)c1N.
What is the InChIKey of 1-methyl-4-pent-1-enylpyrazol-5-amine?
The InChIKey is IGWAFPQFLFOFGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3/c1-3-4-5-6-8-7-11-12(2)9(8)10/h5-7H,3-4,10H2,1-2H3.
What are the key properties of 1-methyl-4-pent-1-enylpyrazol-5-amine?
1-methyl-4-pent-1-enylpyrazol-5-amine has a molecular weight of 165.24 g/mol, XLogP of 1.82, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-pent-1-enylpyrazol-5-amine is sourced from PubChem (CID 123377825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).