3-[2-(methylamino)-2-(2-methylpyrimidin-4-yl)ethyl]pyridin-2-amine

C13H17N5 — CID 113329550

IUPAC3-[2-(methylamino)-2-(2-methylpyrimidin-4-yl)ethyl]pyridin-2-amine
SMILESCNC(Cc1cccnc1N)c1ccnc(C)n1
InChIInChI=1S/C13H17N5/c1-9-16-7-5-11(18-9)12(15-2)8-10-4-3-6-17-13(10)14/h3-7,12,15H,8H2,1-2H3,(H2,14,17)
InChIKeyXZAZRVOJBNAJTH-UHFFFAOYSA-N
MW243.31 g/mol
LogP1.27
Rot. Bonds4

About 3-[2-(methylamino)-2-(2-methylpyrimidin-4-yl)ethyl]pyridin-2-amine

3-[2-(methylamino)-2-(2-methylpyrimidin-4-yl)ethyl]pyridin-2-amine (PubChem CID 113329550) has the molecular formula C13H17N5 and a molecular weight of 243.31 g/mol. Its IUPAC name is 3-[2-(methylamino)-2-(2-methylpyrimidin-4-yl)ethyl]pyridin-2-amine.

Molecular Properties

Compound Name3-[2-(methylamino)-2-(2-methylpyrimidin-4-yl)ethyl]pyridin-2-amine
PubChem CID113329550
Molecular FormulaC13H17N5
Molecular Weight243.31 g/mol
Exact Mass243.15
IUPAC Name3-[2-(methylamino)-2-(2-methylpyrimidin-4-yl)ethyl]pyridin-2-amine
SMILESCNC(Cc1cccnc1N)c1ccnc(C)n1
InChIInChI=1S/C13H17N5/c1-9-16-7-5-11(18-9)12(15-2)8-10-4-3-6-17-13(10)14/h3-7,12,15H,8H2,1-2H3,(H2,14,17)
InChIKeyXZAZRVOJBNAJTH-UHFFFAOYSA-N
XLogP1.27
TPSA76.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-[2-(methylamino)-2-(2-methylfuran-3-yl)ethyl]pyridin-2-amine
CID 113453367
3-[2-(6-methoxypyridazin-3-yl)-2-(methylamino)ethyl]pyridin-2-amine
CID 103374238
3-[2-(methylamino)-2-(2,4,6-trifluorophenyl)ethyl]pyridin-2-amine
CID 107920651
3-ethyl-N-methyl-1-(2-methylpyrimidin-4-yl)pentan-1-amine
CID 82922386
3-[2-(2,6-difluorophenyl)-2-(ethylamino)ethyl]pyridin-2-amine
CID 79522491
3-[2-(ethylamino)-2-(2-methylpyrimidin-4-yl)ethyl]pyridin-4-amine
CID 115530844
3-(2-methylpropyl)pyridin-2-amine
CID 20771927
3-[2-(methylamino)-2-thieno[3,2-b]pyridin-6-ylethyl]pyridin-2-amine
CID 81143119
3-[2-(3-bromo-4-chlorophenyl)-2-(methylamino)ethyl]pyridin-2-amine
CID 115567050
[2-(2-bromo-3-fluorophenyl)-1-(2-methylpyrimidin-4-yl)ethyl]hydrazine
CID 105260420
N-methyl-2-(1-methylbenzimidazol-2-yl)-1-(2-methylpyrimidin-4-yl)ethanamine
CID 115530552
3-[2-(3-bromo-4-fluorophenyl)-2-(methylamino)ethyl]pyridin-2-amine
CID 82809316

Frequently Asked Questions

What is the IUPAC name of 3-[2-(methylamino)-2-(2-methylpyrimidin-4-yl)ethyl]pyridin-2-amine?
The IUPAC name of 3-[2-(methylamino)-2-(2-methylpyrimidin-4-yl)ethyl]pyridin-2-amine (CID 113329550) is 3-[2-(methylamino)-2-(2-methylpyrimidin-4-yl)ethyl]pyridin-2-amine.
What is the SMILES notation for 3-[2-(methylamino)-2-(2-methylpyrimidin-4-yl)ethyl]pyridin-2-amine?
The canonical SMILES for 3-[2-(methylamino)-2-(2-methylpyrimidin-4-yl)ethyl]pyridin-2-amine is CNC(Cc1cccnc1N)c1ccnc(C)n1.
What is the InChIKey of 3-[2-(methylamino)-2-(2-methylpyrimidin-4-yl)ethyl]pyridin-2-amine?
The InChIKey is XZAZRVOJBNAJTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5/c1-9-16-7-5-11(18-9)12(15-2)8-10-4-3-6-17-13(10)14/h3-7,12,15H,8H2,1-2H3,(H2,14,17).
What are the key properties of 3-[2-(methylamino)-2-(2-methylpyrimidin-4-yl)ethyl]pyridin-2-amine?
3-[2-(methylamino)-2-(2-methylpyrimidin-4-yl)ethyl]pyridin-2-amine has a molecular weight of 243.31 g/mol, XLogP of 1.27, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(methylamino)-2-(2-methylpyrimidin-4-yl)ethyl]pyridin-2-amine is sourced from PubChem (CID 113329550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).