N-tert-butyl-7-methoxy-2-methylquinolin-4-amine

C15H20N2O — CID 110433200

IUPACN-tert-butyl-7-methoxy-2-methylquinolin-4-amine
SMILESCOc1ccc2c(NC(C)(C)C)cc(C)nc2c1
InChIInChI=1S/C15H20N2O/c1-10-8-14(17-15(2,3)4)12-7-6-11(18-5)9-13(12)16-10/h6-9H,1-5H3,(H,16,17)
InChIKeyVNNHLRSOLIRLQF-UHFFFAOYSA-N
MW244.34 g/mol
LogP3.76
Rot. Bonds2

About N-tert-butyl-7-methoxy-2-methylquinolin-4-amine

N-tert-butyl-7-methoxy-2-methylquinolin-4-amine (PubChem CID 110433200) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is N-tert-butyl-7-methoxy-2-methylquinolin-4-amine.

Molecular Properties

Compound NameN-tert-butyl-7-methoxy-2-methylquinolin-4-amine
PubChem CID110433200
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC NameN-tert-butyl-7-methoxy-2-methylquinolin-4-amine
SMILESCOc1ccc2c(NC(C)(C)C)cc(C)nc2c1
InChIInChI=1S/C15H20N2O/c1-10-8-14(17-15(2,3)4)12-7-6-11(18-5)9-13(12)16-10/h6-9H,1-5H3,(H,16,17)
InChIKeyVNNHLRSOLIRLQF-UHFFFAOYSA-N
XLogP3.76
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(7-methoxy-2-methylquinolin-4-yl)amino]-3-methylphenol
CID 110435658
N-(4-fluorophenyl)-7-methoxy-2-methylquinolin-4-amine
CID 110435606
7-methoxy-N-(2-methoxyphenyl)-2-methylquinolin-4-amine
CID 110435616
N-(2,2-dimethoxyethyl)-7-methoxy-2-methylquinolin-4-amine
CID 110432925
N-(3,4-dimethoxyphenyl)-7-methoxy-2-methylquinolin-4-amine
CID 110435623
7-methoxy-2-methyl-N-(3-methylphenyl)quinolin-4-amine
CID 110435602
N-cyclopentyl-7-methoxy-2-methylquinolin-4-amine
CID 110432874
7-methoxy-2-methyl-N-(3-propan-2-yloxypropyl)quinolin-4-amine
CID 110432904
4-bromo-7-methoxy-2-methylquinoline
CID 11550580
4-[(7-methoxy-2-methylquinolin-4-yl)amino]benzenesulfonamide
CID 110435636
N-(4-butylphenyl)-7-methoxy-2-methylquinolin-4-amine
CID 22417905
4-(3-methoxyanilino)-2-methylquinolin-7-ol;hydrochloride
CID 135802999

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-7-methoxy-2-methylquinolin-4-amine?
The IUPAC name of N-tert-butyl-7-methoxy-2-methylquinolin-4-amine (CID 110433200) is N-tert-butyl-7-methoxy-2-methylquinolin-4-amine.
What is the SMILES notation for N-tert-butyl-7-methoxy-2-methylquinolin-4-amine?
The canonical SMILES for N-tert-butyl-7-methoxy-2-methylquinolin-4-amine is COc1ccc2c(NC(C)(C)C)cc(C)nc2c1.
What is the InChIKey of N-tert-butyl-7-methoxy-2-methylquinolin-4-amine?
The InChIKey is VNNHLRSOLIRLQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-10-8-14(17-15(2,3)4)12-7-6-11(18-5)9-13(12)16-10/h6-9H,1-5H3,(H,16,17).
What are the key properties of N-tert-butyl-7-methoxy-2-methylquinolin-4-amine?
N-tert-butyl-7-methoxy-2-methylquinolin-4-amine has a molecular weight of 244.34 g/mol, XLogP of 3.76, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-7-methoxy-2-methylquinolin-4-amine is sourced from PubChem (CID 110433200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).