(5-methyl-1H-pyrazol-3-yl)methanamine;hydrochloride

C5H10ClN3 — CID 12983921

IUPAC(5-methyl-1H-pyrazol-3-yl)methanamine;hydrochloride
SMILESCc1cc(CN)n[nH]1.Cl
InChIInChI=1S/C5H9N3.ClH/c1-4-2-5(3-6)8-7-4;/h2H,3,6H2,1H3,(H,7,8);1H
InChIKeySGOQIPZLPMCCMV-UHFFFAOYSA-N
MW147.61 g/mol
LogP0.60
Rot. Bonds1

About (5-methyl-1H-pyrazol-3-yl)methanamine;hydrochloride

(5-methyl-1H-pyrazol-3-yl)methanamine;hydrochloride (PubChem CID 12983921) has the molecular formula C5H10ClN3 and a molecular weight of 147.61 g/mol. Its IUPAC name is (5-methyl-1H-pyrazol-3-yl)methanamine;hydrochloride.

Molecular Properties

Compound Name(5-methyl-1H-pyrazol-3-yl)methanamine;hydrochloride
PubChem CID12983921
Molecular FormulaC5H10ClN3
Molecular Weight147.61 g/mol
Exact Mass147.06
IUPAC Name(5-methyl-1H-pyrazol-3-yl)methanamine;hydrochloride
SMILESCc1cc(CN)n[nH]1.Cl
InChIInChI=1S/C5H9N3.ClH/c1-4-2-5(3-6)8-7-4;/h2H,3,6H2,1H3,(H,7,8);1H
InChIKeySGOQIPZLPMCCMV-UHFFFAOYSA-N
XLogP0.60
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.61
LogP ≤ 50.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(5-methyl-1H-pyrazol-3-yl)propan-2-amine;hydrochloride
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(2R)-1-(5-methyl-1H-pyrazol-3-yl)propan-2-amine
CID 1419095
(2S)-2-N-[(5-methyl-1H-pyrazol-3-yl)methyl]propane-1,2-diamine
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2-(5-methyl-1H-pyrazol-3-yl)acetonitrile
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N'-ethyl-N'-[(5-methyl-1H-pyrazol-3-yl)methyl]ethane-1,2-diamine
CID 103102226
[5-[(2-methylphenyl)methyl]-1H-pyrazol-3-yl]methanamine
CID 115093018
ethane;N-[(5-methyl-1H-pyrazol-3-yl)methyl]ethanamine
CID 171515765
2-[(5-methyl-1H-pyrazol-3-yl)methylamino]ethanol
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4-(5-methyl-1H-pyrazol-3-yl)butan-2-one
CID 82417105
5-methyl-3-(pyrrolidin-1-ylmethyl)-1H-pyrazole
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[4-(5-methyl-1H-pyrazol-3-yl)phenyl]methanamine
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Frequently Asked Questions

What is the IUPAC name of (5-methyl-1H-pyrazol-3-yl)methanamine;hydrochloride?
The IUPAC name of (5-methyl-1H-pyrazol-3-yl)methanamine;hydrochloride (CID 12983921) is (5-methyl-1H-pyrazol-3-yl)methanamine;hydrochloride.
What is the SMILES notation for (5-methyl-1H-pyrazol-3-yl)methanamine;hydrochloride?
The canonical SMILES for (5-methyl-1H-pyrazol-3-yl)methanamine;hydrochloride is Cc1cc(CN)n[nH]1.Cl.
What is the InChIKey of (5-methyl-1H-pyrazol-3-yl)methanamine;hydrochloride?
The InChIKey is SGOQIPZLPMCCMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N3.ClH/c1-4-2-5(3-6)8-7-4;/h2H,3,6H2,1H3,(H,7,8);1H.
What are the key properties of (5-methyl-1H-pyrazol-3-yl)methanamine;hydrochloride?
(5-methyl-1H-pyrazol-3-yl)methanamine;hydrochloride has a molecular weight of 147.61 g/mol, XLogP of 0.60, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methyl-1H-pyrazol-3-yl)methanamine;hydrochloride is sourced from PubChem (CID 12983921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).