ethane;4-methyl-3-(1-methylpyrazol-4-yl)-1-phenylpyrazol-5-amine

C16H21N5 — CID 142337289

IUPACethane;4-methyl-3-(1-methylpyrazol-4-yl)-1-phenylpyrazol-5-amine
SMILESCC.Cc1c(-c2cnn(C)c2)nn(-c2ccccc2)c1N
InChIInChI=1S/C14H15N5.C2H6/c1-10-13(11-8-16-18(2)9-11)17-19(14(10)15)12-6-4-3-5-7-12;1-2/h3-9H,15H2,1-2H3;1-2H3
InChIKeyHOHRWOQVXMIIOE-UHFFFAOYSA-N
MW283.38 g/mol
LogP3.19
Rot. Bonds2

About ethane;4-methyl-3-(1-methylpyrazol-4-yl)-1-phenylpyrazol-5-amine

ethane;4-methyl-3-(1-methylpyrazol-4-yl)-1-phenylpyrazol-5-amine (PubChem CID 142337289) has the molecular formula C16H21N5 and a molecular weight of 283.38 g/mol. Its IUPAC name is ethane;4-methyl-3-(1-methylpyrazol-4-yl)-1-phenylpyrazol-5-amine.

Molecular Properties

Compound Nameethane;4-methyl-3-(1-methylpyrazol-4-yl)-1-phenylpyrazol-5-amine
PubChem CID142337289
Molecular FormulaC16H21N5
Molecular Weight283.38 g/mol
Exact Mass283.18
IUPAC Nameethane;4-methyl-3-(1-methylpyrazol-4-yl)-1-phenylpyrazol-5-amine
SMILESCC.Cc1c(-c2cnn(C)c2)nn(-c2ccccc2)c1N
InChIInChI=1S/C14H15N5.C2H6/c1-10-13(11-8-16-18(2)9-11)17-19(14(10)15)12-6-4-3-5-7-12;1-2/h3-9H,15H2,1-2H3;1-2H3
InChIKeyHOHRWOQVXMIIOE-UHFFFAOYSA-N
XLogP3.19
TPSA61.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.38
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-methyl-1,3-diphenylpyrazol-5-amine
CID 43336769
3-(1-methylpyrazol-4-yl)-1-phenylpyrazol-5-amine
CID 71040961
4-(5-amino-4-methyl-1-phenylpyrazol-3-yl)benzoic acid
CID 145013429
phenyl N-[4-methyl-3-(1-methylpyrazol-4-yl)-1-phenylpyrazol-5-yl]carbamate
CID 89189120
3-(2-bromophenyl)-4-methyl-1-phenylpyrazol-5-amine
CID 43336800
4-methyl-3-(3-methylfuran-2-yl)-1-phenylpyrazol-5-amine
CID 43159004
3-(1,3-dihydrofuro[3,4-c]pyridin-6-yl)-4-methyl-1-phenylpyrazol-5-amine
CID 146550498
1-(3-cyclopropyl-1-phenylpyrazol-5-yl)-3-[4-methyl-3-(1-methylpyrazol-4-yl)-1-phenylpyrazol-5-yl]urea
CID 90168972
4-methyl-3-(2-methyl-1,4-dihydropyrimidin-5-yl)-1-phenylpyrazol-5-amine
CID 146237735
3-cyclopropyl-5-(1-methylpyrazol-4-yl)-2-phenylimidazol-4-amine
CID 62222615
ethane;1-[4-methyl-3-(1-methylpyrazol-4-yl)-1-phenylpyrazol-5-yl]-3-[1-phenyl-3-(2,2,2-trifluoroethyl)pyrazol-5-yl]urea
CID 144629141
[5-(5-amino-4-methyl-1-phenylpyrazol-3-yl)pyrimidin-2-yl]methyl 2,2-dimethylpropanoate
CID 142337250

Frequently Asked Questions

What is the IUPAC name of ethane;4-methyl-3-(1-methylpyrazol-4-yl)-1-phenylpyrazol-5-amine?
The IUPAC name of ethane;4-methyl-3-(1-methylpyrazol-4-yl)-1-phenylpyrazol-5-amine (CID 142337289) is ethane;4-methyl-3-(1-methylpyrazol-4-yl)-1-phenylpyrazol-5-amine.
What is the SMILES notation for ethane;4-methyl-3-(1-methylpyrazol-4-yl)-1-phenylpyrazol-5-amine?
The canonical SMILES for ethane;4-methyl-3-(1-methylpyrazol-4-yl)-1-phenylpyrazol-5-amine is CC.Cc1c(-c2cnn(C)c2)nn(-c2ccccc2)c1N.
What is the InChIKey of ethane;4-methyl-3-(1-methylpyrazol-4-yl)-1-phenylpyrazol-5-amine?
The InChIKey is HOHRWOQVXMIIOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5.C2H6/c1-10-13(11-8-16-18(2)9-11)17-19(14(10)15)12-6-4-3-5-7-12;1-2/h3-9H,15H2,1-2H3;1-2H3.
What are the key properties of ethane;4-methyl-3-(1-methylpyrazol-4-yl)-1-phenylpyrazol-5-amine?
ethane;4-methyl-3-(1-methylpyrazol-4-yl)-1-phenylpyrazol-5-amine has a molecular weight of 283.38 g/mol, XLogP of 3.19, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-methyl-3-(1-methylpyrazol-4-yl)-1-phenylpyrazol-5-amine is sourced from PubChem (CID 142337289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).