2-methyl-N-[(1-propylpyrazol-4-yl)methyl]pyrazol-3-amine

C11H17N5 — CID 115702920

IUPAC2-methyl-N-[(1-propylpyrazol-4-yl)methyl]pyrazol-3-amine
SMILESCCCn1cc(CNc2ccnn2C)cn1
InChIInChI=1S/C11H17N5/c1-3-6-16-9-10(8-14-16)7-12-11-4-5-13-15(11)2/h4-5,8-9,12H,3,6-7H2,1-2H3
InChIKeyVMVMBJKZLROAAG-UHFFFAOYSA-N
MW219.29 g/mol
LogP1.64
Rot. Bonds5

About 2-methyl-N-[(1-propylpyrazol-4-yl)methyl]pyrazol-3-amine

2-methyl-N-[(1-propylpyrazol-4-yl)methyl]pyrazol-3-amine (PubChem CID 115702920) has the molecular formula C11H17N5 and a molecular weight of 219.29 g/mol. Its IUPAC name is 2-methyl-N-[(1-propylpyrazol-4-yl)methyl]pyrazol-3-amine.

Molecular Properties

Compound Name2-methyl-N-[(1-propylpyrazol-4-yl)methyl]pyrazol-3-amine
PubChem CID115702920
Molecular FormulaC11H17N5
Molecular Weight219.29 g/mol
Exact Mass219.15
IUPAC Name2-methyl-N-[(1-propylpyrazol-4-yl)methyl]pyrazol-3-amine
SMILESCCCn1cc(CNc2ccnn2C)cn1
InChIInChI=1S/C11H17N5/c1-3-6-16-9-10(8-14-16)7-12-11-4-5-13-15(11)2/h4-5,8-9,12H,3,6-7H2,1-2H3
InChIKeyVMVMBJKZLROAAG-UHFFFAOYSA-N
XLogP1.64
TPSA47.67 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(2-methylpyrazol-3-yl)-N-[(1-propylpyrazol-4-yl)methyl]methanamine
CID 103674015
1-propyl-N-[(1-propylpyrazol-4-yl)methyl]pyrazol-4-amine;hydrochloride
CID 126965152
5-phenyl-N-[(1-propylpyrazol-4-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine
CID 56899654
1,4-dimethyl-N-[(1-propylpyrazol-4-yl)methyl]pyrazol-5-amine;hydrochloride
CID 126964967
3-methyl-N-[(1-propylpyrazol-4-yl)methyl]pentan-3-amine
CID 115632424
1-ethyl-N-[(1-propylpyrazol-4-yl)methyl]pyrazol-4-amine;hydrochloride
CID 126964986
2,3,4-trifluoro-N-[(1-propylpyrazol-4-yl)methyl]aniline
CID 103571325
N-[(1-ethylpyrazol-4-yl)methyl]-2-propan-2-ylpyrazol-3-amine
CID 122166808
1-(1-ethylpyrazol-4-yl)-N-[(1-propylpyrazol-4-yl)methyl]methanamine
CID 122166789
1-phenyl-N-[(1-propylpyrazol-4-yl)methyl]methanamine;hydrochloride
CID 126966319
3-chloro-N-[(1-propylpyrazol-4-yl)methyl]aniline
CID 103818064
2-ethylsulfonyl-N-[(1-propylpyrazol-4-yl)methyl]aniline
CID 103571450

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(1-propylpyrazol-4-yl)methyl]pyrazol-3-amine?
The IUPAC name of 2-methyl-N-[(1-propylpyrazol-4-yl)methyl]pyrazol-3-amine (CID 115702920) is 2-methyl-N-[(1-propylpyrazol-4-yl)methyl]pyrazol-3-amine.
What is the SMILES notation for 2-methyl-N-[(1-propylpyrazol-4-yl)methyl]pyrazol-3-amine?
The canonical SMILES for 2-methyl-N-[(1-propylpyrazol-4-yl)methyl]pyrazol-3-amine is CCCn1cc(CNc2ccnn2C)cn1.
What is the InChIKey of 2-methyl-N-[(1-propylpyrazol-4-yl)methyl]pyrazol-3-amine?
The InChIKey is VMVMBJKZLROAAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5/c1-3-6-16-9-10(8-14-16)7-12-11-4-5-13-15(11)2/h4-5,8-9,12H,3,6-7H2,1-2H3.
What are the key properties of 2-methyl-N-[(1-propylpyrazol-4-yl)methyl]pyrazol-3-amine?
2-methyl-N-[(1-propylpyrazol-4-yl)methyl]pyrazol-3-amine has a molecular weight of 219.29 g/mol, XLogP of 1.64, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(1-propylpyrazol-4-yl)methyl]pyrazol-3-amine is sourced from PubChem (CID 115702920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).