1,3-dimethyl-N-(1-methylimidazol-2-yl)pyrazol-4-amine

C9H13N5 — CID 102806061

IUPAC1,3-dimethyl-N-(1-methylimidazol-2-yl)pyrazol-4-amine
SMILESCc1nn(C)cc1Nc1nccn1C
InChIInChI=1S/C9H13N5/c1-7-8(6-14(3)12-7)11-9-10-4-5-13(9)2/h4-6H,1-3H3,(H,10,11)
InChIKeyBAQGJGAKISTLRT-UHFFFAOYSA-N
MW191.24 g/mol
LogP1.21
Rot. Bonds2

About 1,3-dimethyl-N-(1-methylimidazol-2-yl)pyrazol-4-amine

1,3-dimethyl-N-(1-methylimidazol-2-yl)pyrazol-4-amine (PubChem CID 102806061) has the molecular formula C9H13N5 and a molecular weight of 191.24 g/mol. Its IUPAC name is 1,3-dimethyl-N-(1-methylimidazol-2-yl)pyrazol-4-amine.

Molecular Properties

Compound Name1,3-dimethyl-N-(1-methylimidazol-2-yl)pyrazol-4-amine
PubChem CID102806061
Molecular FormulaC9H13N5
Molecular Weight191.24 g/mol
Exact Mass191.12
IUPAC Name1,3-dimethyl-N-(1-methylimidazol-2-yl)pyrazol-4-amine
SMILESCc1nn(C)cc1Nc1nccn1C
InChIInChI=1S/C9H13N5/c1-7-8(6-14(3)12-7)11-9-10-4-5-13(9)2/h4-6H,1-3H3,(H,10,11)
InChIKeyBAQGJGAKISTLRT-UHFFFAOYSA-N
XLogP1.21
TPSA47.67 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.24
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1,5-dimethyl-1H-pyrazol-4-yl)-5-methyl-2-pyrimidinamine
CID 134129122
N,N,8-trimethylimidazo[1,5-d][1,2,4]triazin-4-amine
CID 13548828
N,8-dimethylimidazo[1,5-d][1,2,4]triazin-4-amine
CID 13548833
3-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-yl)-1-ethylpyrazol-4-amine
CID 25248658
1-Methyl-3-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)pyrazol-4-amine
CID 25248737
N-[(1-methyl-1H-imidazol-2-yl)methyl]-4-(1-methyl-1H-1,2,4-triazol-5-yl)pyrimidin-2-amine
CID 45190722
4-N,4-N,6-trimethyl-2-N-(2-pyrazol-1-ylethyl)pyrimidine-2,4-diamine
CID 53537047
N-[2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-1-(1H-imidazol-1-yl)propan-2-amine
CID 56718658
1-methyl-3-(1-methyl-1H-imidazol-2-yl)-1H-pyrazol-5-amine
CID 13861132
N-{2-[1-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-1H-imidazol-4-yl]ethyl}acetamide
CID 50956675
(1S)-1-(1-methylimidazol-2-yl)-N-[(3-methyl-1-prop-2-enylpyrazol-4-yl)methyl]butan-1-amine
CID 52387428
1-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-1'-isopropyl-1H,1'H-2,2'-biimidazole
CID 56867218

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-N-(1-methylimidazol-2-yl)pyrazol-4-amine?
The IUPAC name of 1,3-dimethyl-N-(1-methylimidazol-2-yl)pyrazol-4-amine (CID 102806061) is 1,3-dimethyl-N-(1-methylimidazol-2-yl)pyrazol-4-amine.
What is the SMILES notation for 1,3-dimethyl-N-(1-methylimidazol-2-yl)pyrazol-4-amine?
The canonical SMILES for 1,3-dimethyl-N-(1-methylimidazol-2-yl)pyrazol-4-amine is Cc1nn(C)cc1Nc1nccn1C.
What is the InChIKey of 1,3-dimethyl-N-(1-methylimidazol-2-yl)pyrazol-4-amine?
The InChIKey is BAQGJGAKISTLRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N5/c1-7-8(6-14(3)12-7)11-9-10-4-5-13(9)2/h4-6H,1-3H3,(H,10,11).
What are the key properties of 1,3-dimethyl-N-(1-methylimidazol-2-yl)pyrazol-4-amine?
1,3-dimethyl-N-(1-methylimidazol-2-yl)pyrazol-4-amine has a molecular weight of 191.24 g/mol, XLogP of 1.21, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-N-(1-methylimidazol-2-yl)pyrazol-4-amine is sourced from PubChem (CID 102806061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).