N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)-5,6-dimethyl-2-pyridin-4-ylpyrimidin-4-amine

C19H25N5 — CID 133347901

IUPACN-(1-cyclopropyl-5-methylpyrrolidin-3-yl)-5,6-dimethyl-2-pyridin-4-ylpyrimidin-4-amine
SMILESCc1nc(-c2ccncc2)nc(NC2CC(C)N(C3CC3)C2)c1C
InChIInChI=1S/C19H25N5/c1-12-10-16(11-24(12)17-4-5-17)22-18-13(2)14(3)21-19(23-18)15-6-8-20-9-7-15/h6-9,12,16-17H,4-5,10-11H2,1-3H3,(H,21,22,23)
InChIKeyIUEXUVIQOWJHKB-UHFFFAOYSA-N
MW323.44 g/mol
LogP3.19
Rot. Bonds4

About N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)-5,6-dimethyl-2-pyridin-4-ylpyrimidin-4-amine

N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)-5,6-dimethyl-2-pyridin-4-ylpyrimidin-4-amine (PubChem CID 133347901) has the molecular formula C19H25N5 and a molecular weight of 323.44 g/mol. Its IUPAC name is N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)-5,6-dimethyl-2-pyridin-4-ylpyrimidin-4-amine.

Molecular Properties

Compound NameN-(1-cyclopropyl-5-methylpyrrolidin-3-yl)-5,6-dimethyl-2-pyridin-4-ylpyrimidin-4-amine
PubChem CID133347901
Molecular FormulaC19H25N5
Molecular Weight323.44 g/mol
Exact Mass323.21
IUPAC NameN-(1-cyclopropyl-5-methylpyrrolidin-3-yl)-5,6-dimethyl-2-pyridin-4-ylpyrimidin-4-amine
SMILESCc1nc(-c2ccncc2)nc(NC2CC(C)N(C3CC3)C2)c1C
InChIInChI=1S/C19H25N5/c1-12-10-16(11-24(12)17-4-5-17)22-18-13(2)14(3)21-19(23-18)15-6-8-20-9-7-15/h6-9,12,16-17H,4-5,10-11H2,1-3H3,(H,21,22,23)
InChIKeyIUEXUVIQOWJHKB-UHFFFAOYSA-N
XLogP3.19
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.44
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-(3,5-dimethoxyphenyl)pyrrolidin-3-yl]-5,6-dimethyl-2-pyridin-4-ylpyrimidin-4-amine
CID 133357134
N-(3-ethylsulfinylcyclohexyl)-5,6-dimethyl-2-pyridin-4-ylpyrimidin-4-amine
CID 133338091
5-[(5,6-dimethyl-2-pyridin-4-ylpyrimidin-4-yl)amino]-2,3,3a,4,5,6,7,7a-octahydro-1H-indazole-3-carboxamide
CID 133406908
N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)-4-phenyl-1,3,5-triazin-2-amine
CID 154866858
5,6-dimethyl-2-pyridin-4-yl-N-(2,2,5,5-tetramethyloxolan-3-yl)pyrimidin-4-amine
CID 133439232
5,6-dimethyl-N-(piperidin-4-ylmethyl)-2-pyridin-4-ylpyrimidin-4-amine
CID 56768152
N-(1,4-diazabicyclo[2.2.2]octan-2-ylmethyl)-5,6-dimethyl-2-pyridin-4-ylpyrimidin-4-amine
CID 133399802
N-(1,1-dioxothian-4-yl)-5,6-dimethyl-2-pyridin-3-ylpyrimidin-4-amine
CID 167967042
N-[(1,4-dimethylpiperazin-2-yl)methyl]-5,6-dimethyl-2-pyridin-4-ylpyrimidin-4-amine
CID 56789843
N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)-3-nitropyridin-2-amine
CID 133347869
1-cyclopropyl-N-(4-iodophenyl)-5-methylpyrrolidin-3-amine
CID 113491638
1-cyclopropyl-5-methyl-N-(2-pyrazol-1-ylphenyl)pyrrolidin-3-amine
CID 115904145

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)-5,6-dimethyl-2-pyridin-4-ylpyrimidin-4-amine?
The IUPAC name of N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)-5,6-dimethyl-2-pyridin-4-ylpyrimidin-4-amine (CID 133347901) is N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)-5,6-dimethyl-2-pyridin-4-ylpyrimidin-4-amine.
What is the SMILES notation for N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)-5,6-dimethyl-2-pyridin-4-ylpyrimidin-4-amine?
The canonical SMILES for N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)-5,6-dimethyl-2-pyridin-4-ylpyrimidin-4-amine is Cc1nc(-c2ccncc2)nc(NC2CC(C)N(C3CC3)C2)c1C.
What is the InChIKey of N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)-5,6-dimethyl-2-pyridin-4-ylpyrimidin-4-amine?
The InChIKey is IUEXUVIQOWJHKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5/c1-12-10-16(11-24(12)17-4-5-17)22-18-13(2)14(3)21-19(23-18)15-6-8-20-9-7-15/h6-9,12,16-17H,4-5,10-11H2,1-3H3,(H,21,22,23).
What are the key properties of N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)-5,6-dimethyl-2-pyridin-4-ylpyrimidin-4-amine?
N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)-5,6-dimethyl-2-pyridin-4-ylpyrimidin-4-amine has a molecular weight of 323.44 g/mol, XLogP of 3.19, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)-5,6-dimethyl-2-pyridin-4-ylpyrimidin-4-amine is sourced from PubChem (CID 133347901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).