N-methyl-4-[1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]pyridin-2-amine

C15H19N5 — CID 110105580

IUPACN-methyl-4-[1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]pyridin-2-amine
SMILESCNc1cc(C2CCCN2c2cc(C)ncn2)ccn1
InChIInChI=1S/C15H19N5/c1-11-8-15(19-10-18-11)20-7-3-4-13(20)12-5-6-17-14(9-12)16-2/h5-6,8-10,13H,3-4,7H2,1-2H3,(H,16,17)
InChIKeyLHTGDEGFSOABIG-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.56
Rot. Bonds3

About N-methyl-4-[1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]pyridin-2-amine

N-methyl-4-[1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]pyridin-2-amine (PubChem CID 110105580) has the molecular formula C15H19N5 and a molecular weight of 269.35 g/mol. Its IUPAC name is N-methyl-4-[1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]pyridin-2-amine.

Molecular Properties

Compound NameN-methyl-4-[1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]pyridin-2-amine
PubChem CID110105580
Molecular FormulaC15H19N5
Molecular Weight269.35 g/mol
Exact Mass269.16
IUPAC NameN-methyl-4-[1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]pyridin-2-amine
SMILESCNc1cc(C2CCCN2c2cc(C)ncn2)ccn1
InChIInChI=1S/C15H19N5/c1-11-8-15(19-10-18-11)20-7-3-4-13(20)12-5-6-17-14(9-12)16-2/h5-6,8-10,13H,3-4,7H2,1-2H3,(H,16,17)
InChIKeyLHTGDEGFSOABIG-UHFFFAOYSA-N
XLogP2.56
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-4-[1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]pyridin-2-amine?
The IUPAC name of N-methyl-4-[1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]pyridin-2-amine (CID 110105580) is N-methyl-4-[1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]pyridin-2-amine.
What is the SMILES notation for N-methyl-4-[1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]pyridin-2-amine?
The canonical SMILES for N-methyl-4-[1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]pyridin-2-amine is CNc1cc(C2CCCN2c2cc(C)ncn2)ccn1.
What is the InChIKey of N-methyl-4-[1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]pyridin-2-amine?
The InChIKey is LHTGDEGFSOABIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5/c1-11-8-15(19-10-18-11)20-7-3-4-13(20)12-5-6-17-14(9-12)16-2/h5-6,8-10,13H,3-4,7H2,1-2H3,(H,16,17).
What are the key properties of N-methyl-4-[1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]pyridin-2-amine?
N-methyl-4-[1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]pyridin-2-amine has a molecular weight of 269.35 g/mol, XLogP of 2.56, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-[1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]pyridin-2-amine is sourced from PubChem (CID 110105580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).