4-N-benzyl-1,5-naphthyridine-3,4-diamine

C15H14N4 — CID 91584152

IUPAC4-N-benzyl-1,5-naphthyridine-3,4-diamine
SMILESNc1cnc2cccnc2c1NCc1ccccc1
InChIInChI=1S/C15H14N4/c16-12-10-18-13-7-4-8-17-15(13)14(12)19-9-11-5-2-1-3-6-11/h1-8,10H,9,16H2,(H,18,19)
InChIKeyWAZPJFWRXXLHDA-UHFFFAOYSA-N
MW250.31 g/mol
LogP2.82
Rot. Bonds3

About 4-N-benzyl-1,5-naphthyridine-3,4-diamine

4-N-benzyl-1,5-naphthyridine-3,4-diamine (PubChem CID 91584152) has the molecular formula C15H14N4 and a molecular weight of 250.31 g/mol. Its IUPAC name is 4-N-benzyl-1,5-naphthyridine-3,4-diamine.

Molecular Properties

Compound Name4-N-benzyl-1,5-naphthyridine-3,4-diamine
PubChem CID91584152
Molecular FormulaC15H14N4
Molecular Weight250.31 g/mol
Exact Mass250.12
IUPAC Name4-N-benzyl-1,5-naphthyridine-3,4-diamine
SMILESNc1cnc2cccnc2c1NCc1ccccc1
InChIInChI=1S/C15H14N4/c16-12-10-18-13-7-4-8-17-15(13)14(12)19-9-11-5-2-1-3-6-11/h1-8,10H,9,16H2,(H,18,19)
InChIKeyWAZPJFWRXXLHDA-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-2,4-diamine
CID 91308709
1,5-naphthyridine-3,4-diamine
CID 22172703
4-N-benzyl-2,1,3-benzoselenadiazole-4,5-diamine
CID 139215941
N-benzyl-5-bromoquinoxalin-6-amine
CID 130538129
4-N-(1,2-oxazol-5-ylmethyl)quinoline-3,4-diamine
CID 114185848
bis[4-(benzylamino)quinolin-3-yl]methanone
CID 154508571
3-N-(pyridin-4-ylmethyl)quinoline-3,4-diamine
CID 150061818
3-amino-2-(benzylamino)phenol
CID 162373513
N-(pyridin-3-ylmethyl)acridin-9-amine;hydrochloride
CID 18558676
4-N-[4-[(3-aminoquinolin-4-yl)amino]butyl]quinoline-3,4-diamine
CID 149004364
4-N-[(2R)-1-phenylpropan-2-yl]quinoline-3,4-diamine
CID 155388769
2-[(3-aminoquinolin-4-yl)amino]acetic acid
CID 103963211

Frequently Asked Questions

What is the IUPAC name of 4-N-benzyl-1,5-naphthyridine-3,4-diamine?
The IUPAC name of 4-N-benzyl-1,5-naphthyridine-3,4-diamine (CID 91584152) is 4-N-benzyl-1,5-naphthyridine-3,4-diamine.
What is the SMILES notation for 4-N-benzyl-1,5-naphthyridine-3,4-diamine?
The canonical SMILES for 4-N-benzyl-1,5-naphthyridine-3,4-diamine is Nc1cnc2cccnc2c1NCc1ccccc1.
What is the InChIKey of 4-N-benzyl-1,5-naphthyridine-3,4-diamine?
The InChIKey is WAZPJFWRXXLHDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4/c16-12-10-18-13-7-4-8-17-15(13)14(12)19-9-11-5-2-1-3-6-11/h1-8,10H,9,16H2,(H,18,19).
What are the key properties of 4-N-benzyl-1,5-naphthyridine-3,4-diamine?
4-N-benzyl-1,5-naphthyridine-3,4-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-3,4-diamine is sourced from PubChem (CID 91584152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).