3-cyclopropyl-1-methyl-N-[(2-methylpyrazol-3-yl)methyl]pyrazol-5-amine;hydrochloride

C12H18ClN5 — CID 126964555

IUPAC3-cyclopropyl-1-methyl-N-[(2-methylpyrazol-3-yl)methyl]pyrazol-5-amine;hydrochloride
SMILESCl.Cn1nccc1CNc1cc(C2CC2)nn1C
InChIInChI=1S/C12H17N5.ClH/c1-16-10(5-6-14-16)8-13-12-7-11(9-3-4-9)15-17(12)2;/h5-7,9,13H,3-4,8H2,1-2H3;1H
InChIKeyJMYFYUROLUASPP-UHFFFAOYSA-N
MW267.76 g/mol
LogP2.06
Rot. Bonds4

About 3-cyclopropyl-1-methyl-N-[(2-methylpyrazol-3-yl)methyl]pyrazol-5-amine;hydrochloride

3-cyclopropyl-1-methyl-N-[(2-methylpyrazol-3-yl)methyl]pyrazol-5-amine;hydrochloride (PubChem CID 126964555) has the molecular formula C12H18ClN5 and a molecular weight of 267.76 g/mol. Its IUPAC name is 3-cyclopropyl-1-methyl-N-[(2-methylpyrazol-3-yl)methyl]pyrazol-5-amine;hydrochloride.

Molecular Properties

Compound Name3-cyclopropyl-1-methyl-N-[(2-methylpyrazol-3-yl)methyl]pyrazol-5-amine;hydrochloride
PubChem CID126964555
Molecular FormulaC12H18ClN5
Molecular Weight267.76 g/mol
Exact Mass267.13
IUPAC Name3-cyclopropyl-1-methyl-N-[(2-methylpyrazol-3-yl)methyl]pyrazol-5-amine;hydrochloride
SMILESCl.Cn1nccc1CNc1cc(C2CC2)nn1C
InChIInChI=1S/C12H17N5.ClH/c1-16-10(5-6-14-16)8-13-12-7-11(9-3-4-9)15-17(12)2;/h5-7,9,13H,3-4,8H2,1-2H3;1H
InChIKeyJMYFYUROLUASPP-UHFFFAOYSA-N
XLogP2.06
TPSA47.67 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.76
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-cyclopropyl-N-(furan-2-ylmethyl)-1-methylpyrazol-5-amine
CID 122168879
2-cyclopropyl-4-[(2-methylpyrazol-3-yl)methylamino]-1H-pyrimidin-6-one
CID 137016422
3-cyclopropyl-1-methyl-N-[[4-(1H-pyrrolo[2,3-b]pyridin-4-yl)phenyl]methyl]pyrazol-5-amine
CID 57482989
3,5-dimethyl-N-[(2-methylpyrazol-3-yl)methyl]aniline
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CID 43663124
1-cyclopropyl-3-[1-methyl-3-(oxan-3-yl)pyrazol-5-yl]-1-[(2-methylpyrazol-3-yl)methyl]urea
CID 155957495
N-[(2-methylpyrazol-3-yl)methyl]pyridin-4-amine
CID 63302069
1-cyclopropyl-N-[(2-methylpyrazol-3-yl)methyl]imidazol-2-amine
CID 106573717
4-bromo-2,6-dimethyl-N-[(2-methylpyrazol-3-yl)methyl]aniline
CID 54863710
methyl N-(3-cyclopropyl-1-methylpyrazol-5-yl)carbamate
CID 134798076
1-methyl-N-[(2-methylpyrazol-3-yl)methyl]piperidin-4-amine
CID 43663386
1-cyclopentyl-N-[(2-methylpyrazol-3-yl)methyl]pyrazol-4-amine
CID 122166520

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-1-methyl-N-[(2-methylpyrazol-3-yl)methyl]pyrazol-5-amine;hydrochloride?
The IUPAC name of 3-cyclopropyl-1-methyl-N-[(2-methylpyrazol-3-yl)methyl]pyrazol-5-amine;hydrochloride (CID 126964555) is 3-cyclopropyl-1-methyl-N-[(2-methylpyrazol-3-yl)methyl]pyrazol-5-amine;hydrochloride.
What is the SMILES notation for 3-cyclopropyl-1-methyl-N-[(2-methylpyrazol-3-yl)methyl]pyrazol-5-amine;hydrochloride?
The canonical SMILES for 3-cyclopropyl-1-methyl-N-[(2-methylpyrazol-3-yl)methyl]pyrazol-5-amine;hydrochloride is Cl.Cn1nccc1CNc1cc(C2CC2)nn1C.
What is the InChIKey of 3-cyclopropyl-1-methyl-N-[(2-methylpyrazol-3-yl)methyl]pyrazol-5-amine;hydrochloride?
The InChIKey is JMYFYUROLUASPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5.ClH/c1-16-10(5-6-14-16)8-13-12-7-11(9-3-4-9)15-17(12)2;/h5-7,9,13H,3-4,8H2,1-2H3;1H.
What are the key properties of 3-cyclopropyl-1-methyl-N-[(2-methylpyrazol-3-yl)methyl]pyrazol-5-amine;hydrochloride?
3-cyclopropyl-1-methyl-N-[(2-methylpyrazol-3-yl)methyl]pyrazol-5-amine;hydrochloride has a molecular weight of 267.76 g/mol, XLogP of 2.06, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-1-methyl-N-[(2-methylpyrazol-3-yl)methyl]pyrazol-5-amine;hydrochloride is sourced from PubChem (CID 126964555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).