N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-6-(3-methylpiperidin-1-yl)pyrimidin-4-amine

C19H24N6 — CID 127299861

IUPACN-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-6-(3-methylpiperidin-1-yl)pyrimidin-4-amine
SMILESCc1cccc2nc(CNc3cc(N4CCCC(C)C4)ncn3)cn12
InChIInChI=1S/C19H24N6/c1-14-5-4-8-24(11-14)19-9-17(21-13-22-19)20-10-16-12-25-15(2)6-3-7-18(25)23-16/h3,6-7,9,12-14H,4-5,8,10-11H2,1-2H3,(H,20,21,22)
InChIKeySPTUCCASGMHXHE-UHFFFAOYSA-N
MW336.44 g/mol
LogP3.28
Rot. Bonds4

About N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-6-(3-methylpiperidin-1-yl)pyrimidin-4-amine

N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-6-(3-methylpiperidin-1-yl)pyrimidin-4-amine (PubChem CID 127299861) has the molecular formula C19H24N6 and a molecular weight of 336.44 g/mol. Its IUPAC name is N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-6-(3-methylpiperidin-1-yl)pyrimidin-4-amine.

Molecular Properties

Compound NameN-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-6-(3-methylpiperidin-1-yl)pyrimidin-4-amine
PubChem CID127299861
Molecular FormulaC19H24N6
Molecular Weight336.44 g/mol
Exact Mass336.21
IUPAC NameN-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-6-(3-methylpiperidin-1-yl)pyrimidin-4-amine
SMILESCc1cccc2nc(CNc3cc(N4CCCC(C)C4)ncn3)cn12
InChIInChI=1S/C19H24N6/c1-14-5-4-8-24(11-14)19-9-17(21-13-22-19)20-10-16-12-25-15(2)6-3-7-18(25)23-16/h3,6-7,9,12-14H,4-5,8,10-11H2,1-2H3,(H,20,21,22)
InChIKeySPTUCCASGMHXHE-UHFFFAOYSA-N
XLogP3.28
TPSA58.35 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-6-(3-methylpiperidin-1-yl)pyrimidin-4-amine?
The IUPAC name of N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-6-(3-methylpiperidin-1-yl)pyrimidin-4-amine (CID 127299861) is N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-6-(3-methylpiperidin-1-yl)pyrimidin-4-amine.
What is the SMILES notation for N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-6-(3-methylpiperidin-1-yl)pyrimidin-4-amine?
The canonical SMILES for N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-6-(3-methylpiperidin-1-yl)pyrimidin-4-amine is Cc1cccc2nc(CNc3cc(N4CCCC(C)C4)ncn3)cn12.
What is the InChIKey of N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-6-(3-methylpiperidin-1-yl)pyrimidin-4-amine?
The InChIKey is SPTUCCASGMHXHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N6/c1-14-5-4-8-24(11-14)19-9-17(21-13-22-19)20-10-16-12-25-15(2)6-3-7-18(25)23-16/h3,6-7,9,12-14H,4-5,8,10-11H2,1-2H3,(H,20,21,22).
What are the key properties of N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-6-(3-methylpiperidin-1-yl)pyrimidin-4-amine?
N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-6-(3-methylpiperidin-1-yl)pyrimidin-4-amine has a molecular weight of 336.44 g/mol, XLogP of 3.28, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-6-(3-methylpiperidin-1-yl)pyrimidin-4-amine is sourced from PubChem (CID 127299861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).