4-(1,3-dimethylpyrazol-4-yl)-6-(3-methylpyrrolidin-1-yl)pyrimidin-2-amine

C14H20N6 — CID 175165632

IUPAC4-(1,3-dimethylpyrazol-4-yl)-6-(3-methylpyrrolidin-1-yl)pyrimidin-2-amine
SMILESCc1nn(C)cc1-c1cc(N2CCC(C)C2)nc(N)n1
InChIInChI=1S/C14H20N6/c1-9-4-5-20(7-9)13-6-12(16-14(15)17-13)11-8-19(3)18-10(11)2/h6,8-9H,4-5,7H2,1-3H3,(H2,15,16,17)
InChIKeyFARNYNCTZVGTNU-UHFFFAOYSA-N
MW272.36 g/mol
LogP1.61
Rot. Bonds2

About 4-(1,3-dimethylpyrazol-4-yl)-6-(3-methylpyrrolidin-1-yl)pyrimidin-2-amine

4-(1,3-dimethylpyrazol-4-yl)-6-(3-methylpyrrolidin-1-yl)pyrimidin-2-amine (PubChem CID 175165632) has the molecular formula C14H20N6 and a molecular weight of 272.36 g/mol. Its IUPAC name is 4-(1,3-dimethylpyrazol-4-yl)-6-(3-methylpyrrolidin-1-yl)pyrimidin-2-amine.

Molecular Properties

Compound Name4-(1,3-dimethylpyrazol-4-yl)-6-(3-methylpyrrolidin-1-yl)pyrimidin-2-amine
PubChem CID175165632
Molecular FormulaC14H20N6
Molecular Weight272.36 g/mol
Exact Mass272.17
IUPAC Name4-(1,3-dimethylpyrazol-4-yl)-6-(3-methylpyrrolidin-1-yl)pyrimidin-2-amine
SMILESCc1nn(C)cc1-c1cc(N2CCC(C)C2)nc(N)n1
InChIInChI=1S/C14H20N6/c1-9-4-5-20(7-9)13-6-12(16-14(15)17-13)11-8-19(3)18-10(11)2/h6,8-9H,4-5,7H2,1-3H3,(H2,15,16,17)
InChIKeyFARNYNCTZVGTNU-UHFFFAOYSA-N
XLogP1.61
TPSA72.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.36
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

[(3R)-1-[2-amino-6-(1,3-dimethylpyrazol-4-yl)pyrimidin-4-yl]pyrrolidin-3-yl]-methylcarbamic acid
CID 166758966
[1-[2-amino-6-(1,3-dimethylpyrazol-4-yl)pyrimidin-4-yl]-3-methylpyrrolidin-3-yl]-methylcarbamic acid
CID 166758968
4-(3-bromo-1-methylpyrazol-4-yl)-6-[3-(methylamino)azetidin-1-yl]pyrimidin-2-amine
CID 166492499
2-methyl-6-(3-methylpyrrolidin-1-yl)pyrimidin-4-amine
CID 80798590
4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-6-(1-methylpyrazol-4-yl)pyrimidin-2-amine
CID 159912281
4-chloro-6-[(3R)-3-methylpiperidin-1-yl]pyrimidin-2-amine
CID 31537614
6-(3-methylpyrrolidin-1-yl)-2-methylsulfanylpyrimidin-4-amine
CID 80798063
[1-[2-amino-6-[1-(difluoromethyl)-3-methylpyrazol-4-yl]pyrimidin-4-yl]azetidin-3-yl]-methylcarbamic acid
CID 166793462
4-[2-amino-6-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-4-yl]-1-methylpyrazole-5-carbonitrile
CID 166765711
6-(3-methylpyrrolidin-1-yl)pyrimidin-4-amine
CID 78929973
1,3-dimethyl-5-(3-methylpyrrolidin-1-yl)pyrazol-4-amine
CID 61225576
4-(3,4-dimethylpiperazin-1-yl)-6-methylpyrimidin-2-amine
CID 80834015

Frequently Asked Questions

What is the IUPAC name of 4-(1,3-dimethylpyrazol-4-yl)-6-(3-methylpyrrolidin-1-yl)pyrimidin-2-amine?
The IUPAC name of 4-(1,3-dimethylpyrazol-4-yl)-6-(3-methylpyrrolidin-1-yl)pyrimidin-2-amine (CID 175165632) is 4-(1,3-dimethylpyrazol-4-yl)-6-(3-methylpyrrolidin-1-yl)pyrimidin-2-amine.
What is the SMILES notation for 4-(1,3-dimethylpyrazol-4-yl)-6-(3-methylpyrrolidin-1-yl)pyrimidin-2-amine?
The canonical SMILES for 4-(1,3-dimethylpyrazol-4-yl)-6-(3-methylpyrrolidin-1-yl)pyrimidin-2-amine is Cc1nn(C)cc1-c1cc(N2CCC(C)C2)nc(N)n1.
What is the InChIKey of 4-(1,3-dimethylpyrazol-4-yl)-6-(3-methylpyrrolidin-1-yl)pyrimidin-2-amine?
The InChIKey is FARNYNCTZVGTNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N6/c1-9-4-5-20(7-9)13-6-12(16-14(15)17-13)11-8-19(3)18-10(11)2/h6,8-9H,4-5,7H2,1-3H3,(H2,15,16,17).
What are the key properties of 4-(1,3-dimethylpyrazol-4-yl)-6-(3-methylpyrrolidin-1-yl)pyrimidin-2-amine?
4-(1,3-dimethylpyrazol-4-yl)-6-(3-methylpyrrolidin-1-yl)pyrimidin-2-amine has a molecular weight of 272.36 g/mol, XLogP of 1.61, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,3-dimethylpyrazol-4-yl)-6-(3-methylpyrrolidin-1-yl)pyrimidin-2-amine is sourced from PubChem (CID 175165632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).