4-N,6-N-dipyridin-2-ylpyrimidine-4,5,6-triamine

C14H13N7 — CID 19146945

IUPAC4-N,6-N-dipyridin-2-ylpyrimidine-4,5,6-triamine
SMILESNc1c(Nc2ccccn2)ncnc1Nc1ccccn1
InChIInChI=1S/C14H13N7/c15-12-13(20-10-5-1-3-7-16-10)18-9-19-14(12)21-11-6-2-4-8-17-11/h1-9H,15H2,(H2,16,17,18,19,20,21)
InChIKeyRAECGTGSSMSXHZ-UHFFFAOYSA-N
MW279.31 g/mol
LogP2.34
Rot. Bonds4

About 4-N,6-N-dipyridin-2-ylpyrimidine-4,5,6-triamine

4-N,6-N-dipyridin-2-ylpyrimidine-4,5,6-triamine (PubChem CID 19146945) has the molecular formula C14H13N7 and a molecular weight of 279.31 g/mol. Its IUPAC name is 4-N,6-N-dipyridin-2-ylpyrimidine-4,5,6-triamine.

Molecular Properties

Compound Name4-N,6-N-dipyridin-2-ylpyrimidine-4,5,6-triamine
PubChem CID19146945
Molecular FormulaC14H13N7
Molecular Weight279.31 g/mol
Exact Mass279.12
IUPAC Name4-N,6-N-dipyridin-2-ylpyrimidine-4,5,6-triamine
SMILESNc1c(Nc2ccccn2)ncnc1Nc1ccccn1
InChIInChI=1S/C14H13N7/c15-12-13(20-10-5-1-3-7-16-10)18-9-19-14(12)21-11-6-2-4-8-17-11/h1-9H,15H2,(H2,16,17,18,19,20,21)
InChIKeyRAECGTGSSMSXHZ-UHFFFAOYSA-N
XLogP2.34
TPSA101.64 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.31
LogP ≤ 52.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Related Compounds

6-N-phenyl-4-N-pyridin-2-ylpyrimidine-4,5,6-triamine
CID 19146951
4-N,4-N-dimethyl-6-N-pyridin-2-ylpyrimidine-4,5,6-triamine
CID 19136946
4-N-(6-methyl-2-pyridinyl)-6-N-pyridin-2-ylpyrimidine-4,5,6-triamine
CID 22542345
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
4-N-(5-chloro-2-methylphenyl)-6-N-pyridin-2-ylpyrimidine-4,5,6-triamine
CID 22547243
6-N-(3-methoxyphenyl)-4-N-pyridin-2-ylpyrimidine-4,5,6-triamine
CID 22543892
6-(4-methoxyphenoxy)-4-N-pyridin-2-ylpyrimidine-4,5-diamine
CID 19147057
2-N-pyridin-2-ylpyridine-2,3,5-triamine
CID 21436318
N'-[5-amino-6-(pyridin-2-ylamino)pyrimidin-4-yl]-4-methylbenzenesulfonohydrazide
CID 19146999
5-nitro-4-N,6-N-dipyridin-2-ylpyrimidine-4,6-diamine
CID 3623508
N-pyridin-2-ylpyridin-2-amine;hydrochloride
CID 517616

Frequently Asked Questions

What is the IUPAC name of 4-N,6-N-dipyridin-2-ylpyrimidine-4,5,6-triamine?
The IUPAC name of 4-N,6-N-dipyridin-2-ylpyrimidine-4,5,6-triamine (CID 19146945) is 4-N,6-N-dipyridin-2-ylpyrimidine-4,5,6-triamine.
What is the SMILES notation for 4-N,6-N-dipyridin-2-ylpyrimidine-4,5,6-triamine?
The canonical SMILES for 4-N,6-N-dipyridin-2-ylpyrimidine-4,5,6-triamine is Nc1c(Nc2ccccn2)ncnc1Nc1ccccn1.
What is the InChIKey of 4-N,6-N-dipyridin-2-ylpyrimidine-4,5,6-triamine?
The InChIKey is RAECGTGSSMSXHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N7/c15-12-13(20-10-5-1-3-7-16-10)18-9-19-14(12)21-11-6-2-4-8-17-11/h1-9H,15H2,(H2,16,17,18,19,20,21).
What are the key properties of 4-N,6-N-dipyridin-2-ylpyrimidine-4,5,6-triamine?
4-N,6-N-dipyridin-2-ylpyrimidine-4,5,6-triamine has a molecular weight of 279.31 g/mol, XLogP of 2.34, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N,6-N-dipyridin-2-ylpyrimidine-4,5,6-triamine is sourced from PubChem (CID 19146945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).