5-N-methyl-2-N-phenylpyrimidine-2,4,5-triamine

C11H13N5 — CID 175235509

IUPAC5-N-methyl-2-N-phenylpyrimidine-2,4,5-triamine
SMILESCNc1cnc(Nc2ccccc2)nc1N
InChIInChI=1S/C11H13N5/c1-13-9-7-14-11(16-10(9)12)15-8-5-3-2-4-6-8/h2-7,13H,1H3,(H3,12,14,15,16)
InChIKeyPPOVRBKBPAUBIK-UHFFFAOYSA-N
MW215.26 g/mol
LogP1.84
Rot. Bonds3

About 5-N-methyl-2-N-phenylpyrimidine-2,4,5-triamine

5-N-methyl-2-N-phenylpyrimidine-2,4,5-triamine (PubChem CID 175235509) has the molecular formula C11H13N5 and a molecular weight of 215.26 g/mol. Its IUPAC name is 5-N-methyl-2-N-phenylpyrimidine-2,4,5-triamine.

Molecular Properties

Compound Name5-N-methyl-2-N-phenylpyrimidine-2,4,5-triamine
PubChem CID175235509
Molecular FormulaC11H13N5
Molecular Weight215.26 g/mol
Exact Mass215.12
IUPAC Name5-N-methyl-2-N-phenylpyrimidine-2,4,5-triamine
SMILESCNc1cnc(Nc2ccccc2)nc1N
InChIInChI=1S/C11H13N5/c1-13-9-7-14-11(16-10(9)12)15-8-5-3-2-4-6-8/h2-7,13H,1H3,(H3,12,14,15,16)
InChIKeyPPOVRBKBPAUBIK-UHFFFAOYSA-N
XLogP1.84
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.26
LogP ≤ 51.84
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

5-chloro-4-N-methyl-2-N-phenylpyrimidine-2,4-diamine
CID 71458913
5-(4-bromophenyl)-2-N-phenylpyrimidine-2,4-diamine
CID 104609431
6-fluoro-2-N-phenylpyrido[2,3-d]pyrimidine-2,7-diamine
CID 141037386
5-(benzenecarboximidoyl)-2-N-phenylpyrimidine-2,4-diamine;methoxymethane
CID 143150930
ethyl (E)-3-(4-amino-2-anilinopyrimidin-5-yl)prop-2-enoate
CID 18375025
CID 172854912
CID 172854912
carbanide;ethane;5-methyl-2-N,4-N-diphenylpyrimidine-2,4-diamine;yttrium
CID 157300828
5-nitroso-2-N-phenylpyrimidine-2,4,6-triamine
CID 46705553
5-fluoro-4-methoxy-N-phenylpyrimidin-2-amine
CID 121221051
5-chloro-4-N-(2-methylphenyl)-2-N-phenylpyrimidine-2,4-diamine
CID 155665811
N-[4-[[4,5-bis(methylamino)pyrimidin-2-yl]amino]phenyl]methanesulfonamide
CID 145360463
3-N-methyl-2-N-phenylpyridine-2,3-diamine;2-N-phenylpyridine-2,3-diamine
CID 162158889

Frequently Asked Questions

What is the IUPAC name of 5-N-methyl-2-N-phenylpyrimidine-2,4,5-triamine?
The IUPAC name of 5-N-methyl-2-N-phenylpyrimidine-2,4,5-triamine (CID 175235509) is 5-N-methyl-2-N-phenylpyrimidine-2,4,5-triamine.
What is the SMILES notation for 5-N-methyl-2-N-phenylpyrimidine-2,4,5-triamine?
The canonical SMILES for 5-N-methyl-2-N-phenylpyrimidine-2,4,5-triamine is CNc1cnc(Nc2ccccc2)nc1N.
What is the InChIKey of 5-N-methyl-2-N-phenylpyrimidine-2,4,5-triamine?
The InChIKey is PPOVRBKBPAUBIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N5/c1-13-9-7-14-11(16-10(9)12)15-8-5-3-2-4-6-8/h2-7,13H,1H3,(H3,12,14,15,16).
What are the key properties of 5-N-methyl-2-N-phenylpyrimidine-2,4,5-triamine?
5-N-methyl-2-N-phenylpyrimidine-2,4,5-triamine has a molecular weight of 215.26 g/mol, XLogP of 1.84, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-methyl-2-N-phenylpyrimidine-2,4,5-triamine is sourced from PubChem (CID 175235509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).