6-N-phenyl-4-N-pyridin-2-ylpyrimidine-4,5,6-triamine

C15H14N6 — CID 19146951

IUPAC6-N-phenyl-4-N-pyridin-2-ylpyrimidine-4,5,6-triamine
SMILESNc1c(Nc2ccccc2)ncnc1Nc1ccccn1
InChIInChI=1S/C15H14N6/c16-13-14(20-11-6-2-1-3-7-11)18-10-19-15(13)21-12-8-4-5-9-17-12/h1-10H,16H2,(H2,17,18,19,20,21)
InChIKeyIVNNUYGEOSZWCO-UHFFFAOYSA-N
MW278.32 g/mol
LogP2.94
Rot. Bonds4

About 6-N-phenyl-4-N-pyridin-2-ylpyrimidine-4,5,6-triamine

6-N-phenyl-4-N-pyridin-2-ylpyrimidine-4,5,6-triamine (PubChem CID 19146951) has the molecular formula C15H14N6 and a molecular weight of 278.32 g/mol. Its IUPAC name is 6-N-phenyl-4-N-pyridin-2-ylpyrimidine-4,5,6-triamine.

Molecular Properties

Compound Name6-N-phenyl-4-N-pyridin-2-ylpyrimidine-4,5,6-triamine
PubChem CID19146951
Molecular FormulaC15H14N6
Molecular Weight278.32 g/mol
Exact Mass278.13
IUPAC Name6-N-phenyl-4-N-pyridin-2-ylpyrimidine-4,5,6-triamine
SMILESNc1c(Nc2ccccc2)ncnc1Nc1ccccn1
InChIInChI=1S/C15H14N6/c16-13-14(20-11-6-2-1-3-7-11)18-10-19-15(13)21-12-8-4-5-9-17-12/h1-10H,16H2,(H2,17,18,19,20,21)
InChIKeyIVNNUYGEOSZWCO-UHFFFAOYSA-N
XLogP2.94
TPSA88.75 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.32
LogP ≤ 52.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

4-N,6-N-dipyridin-2-ylpyrimidine-4,5,6-triamine
CID 19146945
6-N-(3-methoxyphenyl)-4-N-pyridin-2-ylpyrimidine-4,5,6-triamine
CID 22543892
4-N-(6-methyl-2-pyridinyl)-6-N-pyridin-2-ylpyrimidine-4,5,6-triamine
CID 22542345
4-N,4-N-dimethyl-6-N-pyridin-2-ylpyrimidine-4,5,6-triamine
CID 19136946
6-N-phenyl-4-N-pyridin-2-ylpyrimidine-4,6-diamine
CID 117085780
1-N,4-N-dipyridin-2-ylbenzene-1,4-diamine
CID 139175237
2-N-pyridin-2-ylpyridine-2,3,5-triamine
CID 21436318
6-(4-methylpiperazin-1-yl)-4-N-pyridin-2-ylpyrimidine-4,5-diamine
CID 19138216
6-N-[(4-methylphenyl)methyl]-4-N-pyridin-2-ylpyrimidine-4,5,6-triamine
CID 19146976
N'-[5-amino-6-(pyridin-2-ylamino)pyrimidin-4-yl]-4-methylbenzenesulfonohydrazide
CID 19146999
4-N-(5-chloro-2-methylphenyl)-6-N-pyridin-2-ylpyrimidine-4,5,6-triamine
CID 22547243
6-(4-methoxyphenoxy)-4-N-pyridin-2-ylpyrimidine-4,5-diamine
CID 19147057

Frequently Asked Questions

What is the IUPAC name of 6-N-phenyl-4-N-pyridin-2-ylpyrimidine-4,5,6-triamine?
The IUPAC name of 6-N-phenyl-4-N-pyridin-2-ylpyrimidine-4,5,6-triamine (CID 19146951) is 6-N-phenyl-4-N-pyridin-2-ylpyrimidine-4,5,6-triamine.
What is the SMILES notation for 6-N-phenyl-4-N-pyridin-2-ylpyrimidine-4,5,6-triamine?
The canonical SMILES for 6-N-phenyl-4-N-pyridin-2-ylpyrimidine-4,5,6-triamine is Nc1c(Nc2ccccc2)ncnc1Nc1ccccn1.
What is the InChIKey of 6-N-phenyl-4-N-pyridin-2-ylpyrimidine-4,5,6-triamine?
The InChIKey is IVNNUYGEOSZWCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N6/c16-13-14(20-11-6-2-1-3-7-11)18-10-19-15(13)21-12-8-4-5-9-17-12/h1-10H,16H2,(H2,17,18,19,20,21).
What are the key properties of 6-N-phenyl-4-N-pyridin-2-ylpyrimidine-4,5,6-triamine?
6-N-phenyl-4-N-pyridin-2-ylpyrimidine-4,5,6-triamine has a molecular weight of 278.32 g/mol, XLogP of 2.94, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-phenyl-4-N-pyridin-2-ylpyrimidine-4,5,6-triamine is sourced from PubChem (CID 19146951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).