7-(1-amino-3-methyliminoprop-1-en-2-yl)-N-pyridin-3-yl-1,5-naphthyridin-2-amine

C17H16N6 — CID 144666582

IUPAC7-(1-amino-3-methyliminoprop-1-en-2-yl)-N-pyridin-3-yl-1,5-naphthyridin-2-amine
SMILESC/N=C/C(=CN)c1cnc2ccc(Nc3cccnc3)nc2c1
InChIInChI=1S/C17H16N6/c1-19-9-13(8-18)12-7-16-15(21-10-12)4-5-17(23-16)22-14-3-2-6-20-11-14/h2-11H,18H2,1H3,(H,22,23)/b13-8?,19-9+
InChIKeyHPVNVUHSWCJJAU-IIYYVHRISA-N
MW304.36 g/mol
LogP2.77
Rot. Bonds4

About 7-(1-amino-3-methyliminoprop-1-en-2-yl)-N-pyridin-3-yl-1,5-naphthyridin-2-amine

7-(1-amino-3-methyliminoprop-1-en-2-yl)-N-pyridin-3-yl-1,5-naphthyridin-2-amine (PubChem CID 144666582) has the molecular formula C17H16N6 and a molecular weight of 304.36 g/mol. Its IUPAC name is 7-(1-amino-3-methyliminoprop-1-en-2-yl)-N-pyridin-3-yl-1,5-naphthyridin-2-amine.

Molecular Properties

Compound Name7-(1-amino-3-methyliminoprop-1-en-2-yl)-N-pyridin-3-yl-1,5-naphthyridin-2-amine
PubChem CID144666582
Molecular FormulaC17H16N6
Molecular Weight304.36 g/mol
Exact Mass304.14
IUPAC Name7-(1-amino-3-methyliminoprop-1-en-2-yl)-N-pyridin-3-yl-1,5-naphthyridin-2-amine
SMILESC/N=C/C(=CN)c1cnc2ccc(Nc3cccnc3)nc2c1
InChIInChI=1S/C17H16N6/c1-19-9-13(8-18)12-7-16-15(21-10-12)4-5-17(23-16)22-14-3-2-6-20-11-14/h2-11H,18H2,1H3,(H,22,23)/b13-8?,19-9+
InChIKeyHPVNVUHSWCJJAU-IIYYVHRISA-N
XLogP2.77
TPSA89.08 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.36
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

N-[7-(1-amino-3-methyliminoprop-1-en-2-yl)-1,5-naphthyridin-2-yl]-5-(trifluoromethyl)-1,3,4-thiadiazol-2-amine
CID 157355412
N'-hydroxy-6-(pyridin-3-ylamino)pyridine-3-carboximidamide
CID 159911206
7-[1-amino-3-[(3S)-pyrrolidin-3-yl]iminoprop-1-en-2-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine
CID 159005359
7-[1-amino-3-[3-(4,4-difluoropiperidin-1-yl)propylimino]prop-1-en-2-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine
CID 162614875
2-(6-chloro-1,5-naphthyridin-3-yl)-3-methylimino-1-(2-methyl-3-pyridinyl)prop-1-en-1-amine
CID 148886481
N'-[[7-[(1-amino-3-methyliminoprop-1-en-2-yl)amino]-1,5-naphthyridin-2-yl]amino]ethanethiohydrazide
CID 144666198
7-[3-amino-1-methylimino-4-(4-pyridin-4-ylpiperazin-1-yl)but-2-en-2-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine
CID 163929599
7-[1-amino-3-(2-methoxy-3-pyrrolidin-1-ylpropyl)iminoprop-1-en-2-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine
CID 148722426
7-[1-amino-3-[2-(1-propan-2-ylazetidin-3-yl)oxyethylimino]prop-1-en-2-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine
CID 147983599
2-N-pyridin-3-ylpyridine-2,5-diamine
CID 4764177
2-[[3-amino-2-(6-chloro-1,5-naphthyridin-3-yl)prop-2-enylidene]amino]-N,N-dimethylacetamide
CID 144665730
(Z)-N-methyl-2-[6-(3-nitroanilino)-1,5-naphthyridin-3-yl]prop-1-ene-1,3-diamine
CID 144666964

Frequently Asked Questions

What is the IUPAC name of 7-(1-amino-3-methyliminoprop-1-en-2-yl)-N-pyridin-3-yl-1,5-naphthyridin-2-amine?
The IUPAC name of 7-(1-amino-3-methyliminoprop-1-en-2-yl)-N-pyridin-3-yl-1,5-naphthyridin-2-amine (CID 144666582) is 7-(1-amino-3-methyliminoprop-1-en-2-yl)-N-pyridin-3-yl-1,5-naphthyridin-2-amine.
What is the SMILES notation for 7-(1-amino-3-methyliminoprop-1-en-2-yl)-N-pyridin-3-yl-1,5-naphthyridin-2-amine?
The canonical SMILES for 7-(1-amino-3-methyliminoprop-1-en-2-yl)-N-pyridin-3-yl-1,5-naphthyridin-2-amine is C/N=C/C(=CN)c1cnc2ccc(Nc3cccnc3)nc2c1.
What is the InChIKey of 7-(1-amino-3-methyliminoprop-1-en-2-yl)-N-pyridin-3-yl-1,5-naphthyridin-2-amine?
The InChIKey is HPVNVUHSWCJJAU-IIYYVHRISA-N. The full InChI is InChI=1S/C17H16N6/c1-19-9-13(8-18)12-7-16-15(21-10-12)4-5-17(23-16)22-14-3-2-6-20-11-14/h2-11H,18H2,1H3,(H,22,23)/b13-8?,19-9+.
What are the key properties of 7-(1-amino-3-methyliminoprop-1-en-2-yl)-N-pyridin-3-yl-1,5-naphthyridin-2-amine?
7-(1-amino-3-methyliminoprop-1-en-2-yl)-N-pyridin-3-yl-1,5-naphthyridin-2-amine has a molecular weight of 304.36 g/mol, XLogP of 2.77, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(1-amino-3-methyliminoprop-1-en-2-yl)-N-pyridin-3-yl-1,5-naphthyridin-2-amine is sourced from PubChem (CID 144666582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).