N-methyl-1-[4-methyl-2-(pyridin-2-ylmethyl)pyrimidin-5-yl]ethanamine

C14H18N4 — CID 62769957

IUPACN-methyl-1-[4-methyl-2-(pyridin-2-ylmethyl)pyrimidin-5-yl]ethanamine
SMILESCNC(C)c1cnc(Cc2ccccn2)nc1C
InChIInChI=1S/C14H18N4/c1-10(15-3)13-9-17-14(18-11(13)2)8-12-6-4-5-7-16-12/h4-7,9-10,15H,8H2,1-3H3
InChIKeyGJCSJUNRKSJEGR-UHFFFAOYSA-N
MW242.33 g/mol
LogP2.05
Rot. Bonds4

About N-methyl-1-[4-methyl-2-(pyridin-2-ylmethyl)pyrimidin-5-yl]ethanamine

N-methyl-1-[4-methyl-2-(pyridin-2-ylmethyl)pyrimidin-5-yl]ethanamine (PubChem CID 62769957) has the molecular formula C14H18N4 and a molecular weight of 242.33 g/mol. Its IUPAC name is N-methyl-1-[4-methyl-2-(pyridin-2-ylmethyl)pyrimidin-5-yl]ethanamine.

Molecular Properties

Compound NameN-methyl-1-[4-methyl-2-(pyridin-2-ylmethyl)pyrimidin-5-yl]ethanamine
PubChem CID62769957
Molecular FormulaC14H18N4
Molecular Weight242.33 g/mol
Exact Mass242.15
IUPAC NameN-methyl-1-[4-methyl-2-(pyridin-2-ylmethyl)pyrimidin-5-yl]ethanamine
SMILESCNC(C)c1cnc(Cc2ccccn2)nc1C
InChIInChI=1S/C14H18N4/c1-10(15-3)13-9-17-14(18-11(13)2)8-12-6-4-5-7-16-12/h4-7,9-10,15H,8H2,1-3H3
InChIKeyGJCSJUNRKSJEGR-UHFFFAOYSA-N
XLogP2.05
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.33
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-1-[4-methyl-2-(pyridin-3-ylmethyl)pyrimidin-5-yl]ethanamine
CID 62770847
1-[2-(2,2-dimethylpropyl)-4-methylpyrimidin-5-yl]-N-methylethanamine
CID 63891756
N-methyl-1-[5-methyl-2-(pyridin-2-ylmethyl)pyrimidin-4-yl]methanamine
CID 114245179
N-[2-[4,6-dimethyl-2-(pyridin-2-ylmethyl)pyrimidin-5-yl]ethyl]propan-2-amine
CID 62745110
N-methyl-1-[4-methyl-2-(methylsulfanylmethyl)pyrimidin-5-yl]ethanamine
CID 62771548
6-methyl-5-propan-2-yl-2-(pyridin-2-ylmethyl)pyrimidin-4-amine
CID 55130882
1-[2-[(2-chlorophenyl)sulfanylmethyl]-4-methylpyrimidin-5-yl]-N-methylethanamine
CID 66153716
N-methyl-1-[5-methyl-2-(pyridin-2-ylmethoxy)phenyl]ethanamine
CID 43505122
N-ethyl-1-[4-methyl-2-(pyridin-3-ylmethyl)pyrimidin-5-yl]ethanamine
CID 62770321
2-methyl-N-[[2-(pyridin-2-ylmethyl)pyrimidin-4-yl]methyl]propan-1-amine
CID 62747219
N-ethyl-1-[2-[(2-methoxyphenyl)methyl]-4-methylpyrimidin-5-yl]ethanamine
CID 62771730
1-[2-[(4-fluorophenyl)sulfanylmethyl]-4-methylpyrimidin-5-yl]-N-methylethanamine
CID 66065530

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[4-methyl-2-(pyridin-2-ylmethyl)pyrimidin-5-yl]ethanamine?
The IUPAC name of N-methyl-1-[4-methyl-2-(pyridin-2-ylmethyl)pyrimidin-5-yl]ethanamine (CID 62769957) is N-methyl-1-[4-methyl-2-(pyridin-2-ylmethyl)pyrimidin-5-yl]ethanamine.
What is the SMILES notation for N-methyl-1-[4-methyl-2-(pyridin-2-ylmethyl)pyrimidin-5-yl]ethanamine?
The canonical SMILES for N-methyl-1-[4-methyl-2-(pyridin-2-ylmethyl)pyrimidin-5-yl]ethanamine is CNC(C)c1cnc(Cc2ccccn2)nc1C.
What is the InChIKey of N-methyl-1-[4-methyl-2-(pyridin-2-ylmethyl)pyrimidin-5-yl]ethanamine?
The InChIKey is GJCSJUNRKSJEGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4/c1-10(15-3)13-9-17-14(18-11(13)2)8-12-6-4-5-7-16-12/h4-7,9-10,15H,8H2,1-3H3.
What are the key properties of N-methyl-1-[4-methyl-2-(pyridin-2-ylmethyl)pyrimidin-5-yl]ethanamine?
N-methyl-1-[4-methyl-2-(pyridin-2-ylmethyl)pyrimidin-5-yl]ethanamine has a molecular weight of 242.33 g/mol, XLogP of 2.05, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[4-methyl-2-(pyridin-2-ylmethyl)pyrimidin-5-yl]ethanamine is sourced from PubChem (CID 62769957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).