N,5,6-trimethyl-N-(pyridin-2-ylmethyl)-2-pyrrolidin-1-ylpyrimidin-4-amine

C17H23N5 — CID 134710183

IUPACN,5,6-trimethyl-N-(pyridin-2-ylmethyl)-2-pyrrolidin-1-ylpyrimidin-4-amine
SMILESCc1nc(N2CCCC2)nc(N(C)Cc2ccccn2)c1C
InChIInChI=1S/C17H23N5/c1-13-14(2)19-17(22-10-6-7-11-22)20-16(13)21(3)12-15-8-4-5-9-18-15/h4-5,8-9H,6-7,10-12H2,1-3H3
InChIKeyXEDBVURXNIHRBS-UHFFFAOYSA-N
MW297.41 g/mol
LogP2.73
Rot. Bonds4

About N,5,6-trimethyl-N-(pyridin-2-ylmethyl)-2-pyrrolidin-1-ylpyrimidin-4-amine

N,5,6-trimethyl-N-(pyridin-2-ylmethyl)-2-pyrrolidin-1-ylpyrimidin-4-amine (PubChem CID 134710183) has the molecular formula C17H23N5 and a molecular weight of 297.41 g/mol. Its IUPAC name is N,5,6-trimethyl-N-(pyridin-2-ylmethyl)-2-pyrrolidin-1-ylpyrimidin-4-amine.

Molecular Properties

Compound NameN,5,6-trimethyl-N-(pyridin-2-ylmethyl)-2-pyrrolidin-1-ylpyrimidin-4-amine
PubChem CID134710183
Molecular FormulaC17H23N5
Molecular Weight297.41 g/mol
Exact Mass297.20
IUPAC NameN,5,6-trimethyl-N-(pyridin-2-ylmethyl)-2-pyrrolidin-1-ylpyrimidin-4-amine
SMILESCc1nc(N2CCCC2)nc(N(C)Cc2ccccn2)c1C
InChIInChI=1S/C17H23N5/c1-13-14(2)19-17(22-10-6-7-11-22)20-16(13)21(3)12-15-8-4-5-9-18-15/h4-5,8-9H,6-7,10-12H2,1-3H3
InChIKeyXEDBVURXNIHRBS-UHFFFAOYSA-N
XLogP2.73
TPSA45.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.41
LogP ≤ 52.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N,5,6-trimethyl-N-(pyridin-3-ylmethyl)-2-pyrrolidin-1-ylpyrimidin-4-amine
CID 50972618
N,4-dimethyl-N-(pyridin-2-ylmethyl)phthalazin-1-amine
CID 171327483
2-ethyl-4-N,5-dimethyl-4-N-(pyridin-2-ylmethyl)pyrimidine-4,6-diamine
CID 80993245
6-chloro-2-ethyl-N,5-dimethyl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine
CID 80971281
6-hydrazinyl-N,2,5-trimethyl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine
CID 80905729
3-chloro-N-methyl-N-(pyridin-2-ylmethyl)pyridin-2-amine
CID 75515545
6-chloro-N,5-dimethyl-2-propyl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine
CID 80971182
N,5-dimethyl-N-(pyridin-2-ylmethyl)pyrimidin-2-amine
CID 171328176
3-(aminomethyl)-N-methyl-N-(pyridin-2-ylmethyl)pyrazin-2-amine
CID 62672521
1-(6-ethoxy-4-methylquinazolin-2-yl)-N-methyl-N-(pyridin-2-ylmethyl)piperidine-3-carboxamide
CID 45222783
N-methyl-N-(pyridin-2-ylmethyl)pyrrolidine-1-carboxamide
CID 115590459
4-(aminomethyl)-N-methyl-N-(pyridin-2-ylmethyl)pyridazin-3-amine
CID 80507638

Frequently Asked Questions

What is the IUPAC name of N,5,6-trimethyl-N-(pyridin-2-ylmethyl)-2-pyrrolidin-1-ylpyrimidin-4-amine?
The IUPAC name of N,5,6-trimethyl-N-(pyridin-2-ylmethyl)-2-pyrrolidin-1-ylpyrimidin-4-amine (CID 134710183) is N,5,6-trimethyl-N-(pyridin-2-ylmethyl)-2-pyrrolidin-1-ylpyrimidin-4-amine.
What is the SMILES notation for N,5,6-trimethyl-N-(pyridin-2-ylmethyl)-2-pyrrolidin-1-ylpyrimidin-4-amine?
The canonical SMILES for N,5,6-trimethyl-N-(pyridin-2-ylmethyl)-2-pyrrolidin-1-ylpyrimidin-4-amine is Cc1nc(N2CCCC2)nc(N(C)Cc2ccccn2)c1C.
What is the InChIKey of N,5,6-trimethyl-N-(pyridin-2-ylmethyl)-2-pyrrolidin-1-ylpyrimidin-4-amine?
The InChIKey is XEDBVURXNIHRBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N5/c1-13-14(2)19-17(22-10-6-7-11-22)20-16(13)21(3)12-15-8-4-5-9-18-15/h4-5,8-9H,6-7,10-12H2,1-3H3.
What are the key properties of N,5,6-trimethyl-N-(pyridin-2-ylmethyl)-2-pyrrolidin-1-ylpyrimidin-4-amine?
N,5,6-trimethyl-N-(pyridin-2-ylmethyl)-2-pyrrolidin-1-ylpyrimidin-4-amine has a molecular weight of 297.41 g/mol, XLogP of 2.73, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,5,6-trimethyl-N-(pyridin-2-ylmethyl)-2-pyrrolidin-1-ylpyrimidin-4-amine is sourced from PubChem (CID 134710183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).