4-N-benzyl-1,5-naphthyridine-2,4-diamine

C15H14N4 — CID 91308709

IUPAC4-N-benzyl-1,5-naphthyridine-2,4-diamine
SMILESNc1cc(NCc2ccccc2)c2ncccc2n1
InChIInChI=1S/C15H14N4/c16-14-9-13(15-12(19-14)7-4-8-17-15)18-10-11-5-2-1-3-6-11/h1-9H,10H2,(H3,16,18,19)
InChIKeyOTHCUILNNWFEBL-UHFFFAOYSA-N
MW250.31 g/mol
LogP2.82
Rot. Bonds3

About 4-N-benzyl-1,5-naphthyridine-2,4-diamine

4-N-benzyl-1,5-naphthyridine-2,4-diamine (PubChem CID 91308709) has the molecular formula C15H14N4 and a molecular weight of 250.31 g/mol. Its IUPAC name is 4-N-benzyl-1,5-naphthyridine-2,4-diamine.

Molecular Properties

Compound Name4-N-benzyl-1,5-naphthyridine-2,4-diamine
PubChem CID91308709
Molecular FormulaC15H14N4
Molecular Weight250.31 g/mol
Exact Mass250.12
IUPAC Name4-N-benzyl-1,5-naphthyridine-2,4-diamine
SMILESNc1cc(NCc2ccccc2)c2ncccc2n1
InChIInChI=1S/C15H14N4/c16-14-9-13(15-12(19-14)7-4-8-17-15)18-10-11-5-2-1-3-6-11/h1-9H,10H2,(H3,16,18,19)
InChIKeyOTHCUILNNWFEBL-UHFFFAOYSA-N
XLogP2.82
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.31
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-N-benzyl-1,5-naphthyridine-3,4-diamine
CID 91584152
N-benzyl-5-bromoquinoxalin-6-amine
CID 130538129
4-N-(1-amino-2-methylhexan-2-yl)-1,5-naphthyridine-2,4-diamine
CID 171782266
4-[[(2-aminoquinolin-4-yl)amino]methyl]-N'-hydroxybenzenecarboximidamide
CID 154039588
2-N,4-N-dibenzylpyrimidine-2,4,6-triamine
CID 100996925
3-N-benzyl-6-bromopyridine-2,3-diamine
CID 121384108
8-(benzylamino)quinoline-5-carboxamide
CID 58516198
N-benzyl-3-bromopyridin-2-amine
CID 11708714
7-[[(2-methylsulfanyl-3-pyridinyl)amino]methyl]quinolin-2-amine
CID 171501156
6-N-benzyl-7-fluoroisoquinoline-1,6-diamine
CID 70924395
4-N-benzylpyrimidine-4,6-diamine
CID 3031503
1-N-benzyl-2-N-[2-(benzylamino)phenyl]benzene-1,2-diamine
CID 59193671

Frequently Asked Questions

What is the IUPAC name of 4-N-benzyl-1,5-naphthyridine-2,4-diamine?
The IUPAC name of 4-N-benzyl-1,5-naphthyridine-2,4-diamine (CID 91308709) is 4-N-benzyl-1,5-naphthyridine-2,4-diamine.
What is the SMILES notation for 4-N-benzyl-1,5-naphthyridine-2,4-diamine?
The canonical SMILES for 4-N-benzyl-1,5-naphthyridine-2,4-diamine is Nc1cc(NCc2ccccc2)c2ncccc2n1.
What is the InChIKey of 4-N-benzyl-1,5-naphthyridine-2,4-diamine?
The InChIKey is OTHCUILNNWFEBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4/c16-14-9-13(15-12(19-14)7-4-8-17-15)18-10-11-5-2-1-3-6-11/h1-9H,10H2,(H3,16,18,19).
What are the key properties of 4-N-benzyl-1,5-naphthyridine-2,4-diamine?
4-N-benzyl-1,5-naphthyridine-2,4-diamine has a molecular weight of 250.31 g/mol, XLogP of 2.82, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-benzyl-1,5-naphthyridine-2,4-diamine is sourced from PubChem (CID 91308709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).