ethane;3-methyl-1,7-naphthyridine-6-carboximidamide

C12H16N4 — CID 172622984

IUPACethane;3-methyl-1,7-naphthyridine-6-carboximidamide
SMILESCC.[H]/N=C(\N)c1cc2cc(C)cnc2cn1
InChIInChI=1S/C10H10N4.C2H6/c1-6-2-7-3-8(10(11)12)14-5-9(7)13-4-6;1-2/h2-5H,1H3,(H3,11,12);1-2H3
InChIKeyFBTMQNALWODLJC-UHFFFAOYSA-N
MW216.29 g/mol
LogP2.25
Rot. Bonds1

About ethane;3-methyl-1,7-naphthyridine-6-carboximidamide

ethane;3-methyl-1,7-naphthyridine-6-carboximidamide (PubChem CID 172622984) has the molecular formula C12H16N4 and a molecular weight of 216.29 g/mol. Its IUPAC name is ethane;3-methyl-1,7-naphthyridine-6-carboximidamide.

Molecular Properties

Compound Nameethane;3-methyl-1,7-naphthyridine-6-carboximidamide
PubChem CID172622984
Molecular FormulaC12H16N4
Molecular Weight216.29 g/mol
Exact Mass216.14
IUPAC Nameethane;3-methyl-1,7-naphthyridine-6-carboximidamide
SMILESCC.[H]/N=C(\N)c1cc2cc(C)cnc2cn1
InChIInChI=1S/C10H10N4.C2H6/c1-6-2-7-3-8(10(11)12)14-5-9(7)13-4-6;1-2/h2-5H,1H3,(H3,11,12);1-2H3
InChIKeyFBTMQNALWODLJC-UHFFFAOYSA-N
XLogP2.25
TPSA75.65 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.29
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

6-methylpyrido[2,3-d]pyrimidine-2-carboximidamide
CID 172623035
isoquinoline-3-carboximidamide
CID 5069411
3,5-dimethylpyridine-2-carboximidamide
CID 112703746
ethane;6-methylquinazoline-2-carboximidamide
CID 172623100
5-(4,6-dimethylpyrimidin-2-yl)sulfanylpyridine-2-carboximidamide
CID 113321389
2-prop-1-en-2-yl-3H-imidazo[4,5-c]pyridine-6-carboximidamide
CID 86724602
4-methyl-5-nitropyridine-2-carboximidamide;hydrochloride
CID 53484979
7-tert-butylpyrido[3,2-d]pyrimidine-2-carboximidamide
CID 164792579
6-chloro-4-methylpyridine-2-carboximidamide;hydrochloride
CID 53484967
ethane;6-methyl-1,5-naphthyridine-2-carboximidamide
CID 172623231
5-methoxypyridine-2-carboximidamide;hydrochloride
CID 53484941
6-amino-2-methylpyrimidine-4-carboximidamide
CID 130647809

Frequently Asked Questions

What is the IUPAC name of ethane;3-methyl-1,7-naphthyridine-6-carboximidamide?
The IUPAC name of ethane;3-methyl-1,7-naphthyridine-6-carboximidamide (CID 172622984) is ethane;3-methyl-1,7-naphthyridine-6-carboximidamide.
What is the SMILES notation for ethane;3-methyl-1,7-naphthyridine-6-carboximidamide?
The canonical SMILES for ethane;3-methyl-1,7-naphthyridine-6-carboximidamide is CC.[H]/N=C(\N)c1cc2cc(C)cnc2cn1.
What is the InChIKey of ethane;3-methyl-1,7-naphthyridine-6-carboximidamide?
The InChIKey is FBTMQNALWODLJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4.C2H6/c1-6-2-7-3-8(10(11)12)14-5-9(7)13-4-6;1-2/h2-5H,1H3,(H3,11,12);1-2H3.
What are the key properties of ethane;3-methyl-1,7-naphthyridine-6-carboximidamide?
ethane;3-methyl-1,7-naphthyridine-6-carboximidamide has a molecular weight of 216.29 g/mol, XLogP of 2.25, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-methyl-1,7-naphthyridine-6-carboximidamide is sourced from PubChem (CID 172622984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).