7-chloro-4-methylquinoline-2-carboximidamide

C11H10ClN3 — CID 82573454

IUPAC7-chloro-4-methylquinoline-2-carboximidamide
SMILES[H]/N=C(\N)c1cc(C)c2ccc(Cl)cc2n1
InChIInChI=1S/C11H10ClN3/c1-6-4-10(11(13)14)15-9-5-7(12)2-3-8(6)9/h2-5H,1H3,(H3,13,14)
InChIKeyGBEMIINCKBDECM-UHFFFAOYSA-N
MW219.68 g/mol
LogP2.48
Rot. Bonds1

About 7-chloro-4-methylquinoline-2-carboximidamide

7-chloro-4-methylquinoline-2-carboximidamide (PubChem CID 82573454) has the molecular formula C11H10ClN3 and a molecular weight of 219.68 g/mol. Its IUPAC name is 7-chloro-4-methylquinoline-2-carboximidamide.

Molecular Properties

Compound Name7-chloro-4-methylquinoline-2-carboximidamide
PubChem CID82573454
Molecular FormulaC11H10ClN3
Molecular Weight219.68 g/mol
Exact Mass219.06
IUPAC Name7-chloro-4-methylquinoline-2-carboximidamide
SMILES[H]/N=C(\N)c1cc(C)c2ccc(Cl)cc2n1
InChIInChI=1S/C11H10ClN3/c1-6-4-10(11(13)14)15-9-5-7(12)2-3-8(6)9/h2-5H,1H3,(H3,13,14)
InChIKeyGBEMIINCKBDECM-UHFFFAOYSA-N
XLogP2.48
TPSA62.76 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.68
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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

5,7-dichloroquinoline-2-carboximidamide;hydrochloride
CID 82248568
methyl 7-chloro-4-methylquinoline-2-carboxylate
CID 82574602
2-(2,5-dichlorophenyl)sulfanyl-6-methylpyrimidine-4-carboximidamide
CID 107551733
6-chloro-4-methylpyridine-2-carboximidamide;hydrochloride
CID 53484967
ethane;6-methyl-1,5-naphthyridine-2-carboximidamide
CID 172623231
2-(4-chlorophenoxy)-6-methylpyrimidine-4-carboximidamide
CID 107550822
7-chloro-2-methylquinoline-4-carboxamide
CID 82574049
6-amino-2-methylpyrimidine-4-carboximidamide
CID 130647809
2-(2,5-dichlorophenoxy)-4,6-dimethylpyridine-3-carboximidamide
CID 61175597
4-[(7-chloro-4-methylquinolin-2-yl)amino]cyclohexan-1-ol
CID 31196506
4-chloro-2-(2,5-dimethylphenyl)sulfanylbenzenecarboximidamide
CID 63093373
2-(4-chloro-2,6-dimethylphenoxy)-6-methylpyridine-4-carboximidamide
CID 114769235

Frequently Asked Questions

What is the IUPAC name of 7-chloro-4-methylquinoline-2-carboximidamide?
The IUPAC name of 7-chloro-4-methylquinoline-2-carboximidamide (CID 82573454) is 7-chloro-4-methylquinoline-2-carboximidamide.
What is the SMILES notation for 7-chloro-4-methylquinoline-2-carboximidamide?
The canonical SMILES for 7-chloro-4-methylquinoline-2-carboximidamide is [H]/N=C(\N)c1cc(C)c2ccc(Cl)cc2n1.
What is the InChIKey of 7-chloro-4-methylquinoline-2-carboximidamide?
The InChIKey is GBEMIINCKBDECM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClN3/c1-6-4-10(11(13)14)15-9-5-7(12)2-3-8(6)9/h2-5H,1H3,(H3,13,14).
What are the key properties of 7-chloro-4-methylquinoline-2-carboximidamide?
7-chloro-4-methylquinoline-2-carboximidamide has a molecular weight of 219.68 g/mol, XLogP of 2.48, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-4-methylquinoline-2-carboximidamide is sourced from PubChem (CID 82573454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).