1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyrazol-3-amine

C9H13N5 — CID 60808842

IUPAC1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyrazol-3-amine
SMILESCc1[nH]ncc1CNc1ccn(C)n1
InChIInChI=1S/C9H13N5/c1-7-8(6-11-12-7)5-10-9-3-4-14(2)13-9/h3-4,6H,5H2,1-2H3,(H,10,13)(H,11,12)
InChIKeyCMVXYGAEPZMOKZ-UHFFFAOYSA-N
MW191.24 g/mol
LogP1.06
Rot. Bonds3

About 1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyrazol-3-amine

1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyrazol-3-amine (PubChem CID 60808842) has the molecular formula C9H13N5 and a molecular weight of 191.24 g/mol. Its IUPAC name is 1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyrazol-3-amine.

Molecular Properties

Compound Name1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyrazol-3-amine
PubChem CID60808842
Molecular FormulaC9H13N5
Molecular Weight191.24 g/mol
Exact Mass191.12
IUPAC Name1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyrazol-3-amine
SMILESCc1[nH]ncc1CNc1ccn(C)n1
InChIInChI=1S/C9H13N5/c1-7-8(6-11-12-7)5-10-9-3-4-14(2)13-9/h3-4,6H,5H2,1-2H3,(H,10,13)(H,11,12)
InChIKeyCMVXYGAEPZMOKZ-UHFFFAOYSA-N
XLogP1.06
TPSA58.53 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.24
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-methyl-N-[(5-thiophen-2-yl-1H-pyrazol-4-yl)methyl]pyrazol-3-amine
CID 54921126
2-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyrimidin-4-amine
CID 62784735
N-[(1,3-dimethylpyrazol-4-yl)methyl]-1-methylpyrazol-3-amine;hydrochloride
CID 126963985
N-[(2-ethylphenyl)methyl]-1-methylpyrazol-3-amine
CID 62392134
1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]imidazol-2-amine
CID 62133116
1-methyl-N-[[2,4,6-trimethyl-3-[[(1-methylpyrazol-3-yl)amino]methyl]-5-[[2,4,6-trimethyl-3,5-bis[[(1-methylpyrazol-3-yl)amino]methyl]phenyl]methyl]phenyl]methyl]pyrazol-3-amine
CID 122206251
N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-pyrazol-1-ylaniline
CID 43705914
1-methyl-N-[(2,3,4-trimethoxyphenyl)methyl]pyrazol-3-amine
CID 60809473
1-methyl-5-[(5-methyl-1H-pyrazol-4-yl)methylamino]pyridin-2-one
CID 60932541
1-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyrazol-3-amine
CID 131181946
1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]tetrazol-5-amine
CID 63152369
6-imidazol-1-yl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyridin-3-amine
CID 43710749

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyrazol-3-amine?
The IUPAC name of 1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyrazol-3-amine (CID 60808842) is 1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyrazol-3-amine.
What is the SMILES notation for 1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyrazol-3-amine?
The canonical SMILES for 1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyrazol-3-amine is Cc1[nH]ncc1CNc1ccn(C)n1.
What is the InChIKey of 1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyrazol-3-amine?
The InChIKey is CMVXYGAEPZMOKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N5/c1-7-8(6-11-12-7)5-10-9-3-4-14(2)13-9/h3-4,6H,5H2,1-2H3,(H,10,13)(H,11,12).
What are the key properties of 1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyrazol-3-amine?
1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyrazol-3-amine has a molecular weight of 191.24 g/mol, XLogP of 1.06, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyrazol-3-amine is sourced from PubChem (CID 60808842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).