2-chloro-5-methyl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine

C11H11ClN4 — CID 79076173

IUPAC2-chloro-5-methyl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine
SMILESCc1cnc(Cl)nc1NCc1ccccn1
InChIInChI=1S/C11H11ClN4/c1-8-6-15-11(12)16-10(8)14-7-9-4-2-3-5-13-9/h2-6H,7H2,1H3,(H,14,15,16)
InChIKeyUKNGTPPVWINYAV-UHFFFAOYSA-N
MW234.69 g/mol
LogP2.45
Rot. Bonds3

About 2-chloro-5-methyl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine

2-chloro-5-methyl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine (PubChem CID 79076173) has the molecular formula C11H11ClN4 and a molecular weight of 234.69 g/mol. Its IUPAC name is 2-chloro-5-methyl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name2-chloro-5-methyl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine
PubChem CID79076173
Molecular FormulaC11H11ClN4
Molecular Weight234.69 g/mol
Exact Mass234.07
IUPAC Name2-chloro-5-methyl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine
SMILESCc1cnc(Cl)nc1NCc1ccccn1
InChIInChI=1S/C11H11ClN4/c1-8-6-15-11(12)16-10(8)14-7-9-4-2-3-5-13-9/h2-6H,7H2,1H3,(H,14,15,16)
InChIKeyUKNGTPPVWINYAV-UHFFFAOYSA-N
XLogP2.45
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.69
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-methyl-2-N,4-N-bis(pyridin-2-ylmethyl)pyrimidine-2,4-diamine
CID 71922543
2-hydrazinyl-5-methyl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine
CID 80943748
2-chloro-5-methyl-N-[(5-methylpyrazin-2-yl)methyl]pyrimidin-4-amine
CID 79073684
2-chloro-6-methyl-N-(pyridin-2-ylmethyl)thieno[2,3-d]pyrimidin-4-amine
CID 82066295
6-chloro-2,5-dimethyl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine
CID 63728239
2-chloro-5-methyl-N-(1H-pyrazol-5-ylmethyl)pyrimidin-4-amine
CID 106194417
4-[[(2-chloro-5-methylpyrimidin-4-yl)amino]methyl]phenol
CID 106196702
5-chloro-2-N-methyl-4-N-(pyridin-2-ylmethyl)pyrimidine-2,4-diamine
CID 80777970
2-chloro-6-methyl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine
CID 62476257
6-chloro-4-methyl-N-(pyridin-2-ylmethyl)pyridin-3-amine
CID 104599914
6-methyl-2-N-(pyridin-2-ylmethyl)pyridine-2,3-diamine
CID 81132178
5-bromo-2-chloro-N-[(6-methyl-2-pyridinyl)methyl]pyrimidin-4-amine
CID 79073678

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-methyl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine?
The IUPAC name of 2-chloro-5-methyl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine (CID 79076173) is 2-chloro-5-methyl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine.
What is the SMILES notation for 2-chloro-5-methyl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine?
The canonical SMILES for 2-chloro-5-methyl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine is Cc1cnc(Cl)nc1NCc1ccccn1.
What is the InChIKey of 2-chloro-5-methyl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine?
The InChIKey is UKNGTPPVWINYAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11ClN4/c1-8-6-15-11(12)16-10(8)14-7-9-4-2-3-5-13-9/h2-6H,7H2,1H3,(H,14,15,16).
What are the key properties of 2-chloro-5-methyl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine?
2-chloro-5-methyl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine has a molecular weight of 234.69 g/mol, XLogP of 2.45, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-methyl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine is sourced from PubChem (CID 79076173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).