4-tert-butyl-7-methylquinolin-3-amine

C14H18N2 — CID 105468035

IUPAC4-tert-butyl-7-methylquinolin-3-amine
SMILESCc1ccc2c(C(C)(C)C)c(N)cnc2c1
InChIInChI=1S/C14H18N2/c1-9-5-6-10-12(7-9)16-8-11(15)13(10)14(2,3)4/h5-8H,15H2,1-4H3
InChIKeyJLDZERPREUFBSK-UHFFFAOYSA-N
MW214.31 g/mol
LogP3.42
Rot. Bonds

About 4-tert-butyl-7-methylquinolin-3-amine

4-tert-butyl-7-methylquinolin-3-amine (PubChem CID 105468035) has the molecular formula C14H18N2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 4-tert-butyl-7-methylquinolin-3-amine.

Molecular Properties

Compound Name4-tert-butyl-7-methylquinolin-3-amine
PubChem CID105468035
Molecular FormulaC14H18N2
Molecular Weight214.31 g/mol
Exact Mass214.15
IUPAC Name4-tert-butyl-7-methylquinolin-3-amine
SMILESCc1ccc2c(C(C)(C)C)c(N)cnc2c1
InChIInChI=1S/C14H18N2/c1-9-5-6-10-12(7-9)16-8-11(15)13(10)14(2,3)4/h5-8H,15H2,1-4H3
InChIKeyJLDZERPREUFBSK-UHFFFAOYSA-N
XLogP3.42
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-tert-butyl-3-fluoro-7-methylquinoline
CID 105471465
(4-tert-butyl-7-methylquinolin-3-yl)methanamine
CID 105485981
9-tert-butyl-3,6-dimethylacridine
CID 159242363
methyl 3-amino-7-methylquinoline-4-carboxylate
CID 115029491
9-tert-butyl-3,4,6-trimethylacridine
CID 160660304
4-tert-butyl-6-methylquinoline-3-carbonitrile
CID 105482297
carbon dioxide;7-methylquinolin-4-amine
CID 123936189
3-fluoro-8-methylbenzo[f][1,7]naphthyridine
CID 141377178
2-tert-butyl-6-methylquinolin-4-amine
CID 62202003
2-tert-butyl-6-methylquinoxaline;propane
CID 142320460
7-methyl-2-(trifluoromethyl)quinolin-4-amine
CID 24947251
6-methyl-4-N-phenylquinoline-3,4-diamine
CID 142830758

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-7-methylquinolin-3-amine?
The IUPAC name of 4-tert-butyl-7-methylquinolin-3-amine (CID 105468035) is 4-tert-butyl-7-methylquinolin-3-amine.
What is the SMILES notation for 4-tert-butyl-7-methylquinolin-3-amine?
The canonical SMILES for 4-tert-butyl-7-methylquinolin-3-amine is Cc1ccc2c(C(C)(C)C)c(N)cnc2c1.
What is the InChIKey of 4-tert-butyl-7-methylquinolin-3-amine?
The InChIKey is JLDZERPREUFBSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2/c1-9-5-6-10-12(7-9)16-8-11(15)13(10)14(2,3)4/h5-8H,15H2,1-4H3.
What are the key properties of 4-tert-butyl-7-methylquinolin-3-amine?
4-tert-butyl-7-methylquinolin-3-amine has a molecular weight of 214.31 g/mol, XLogP of 3.42, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-7-methylquinolin-3-amine is sourced from PubChem (CID 105468035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).