N-tert-butyl-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)pentan-1-amine

C19H32N2 — CID 83039796

IUPACN-tert-butyl-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)pentan-1-amine
SMILESCCCC(CNC(C)(C)C)N1CC(C)Cc2ccccc21
InChIInChI=1S/C19H32N2/c1-6-9-17(13-20-19(3,4)5)21-14-15(2)12-16-10-7-8-11-18(16)21/h7-8,10-11,15,17,20H,6,9,12-14H2,1-5H3
InChIKeyLKXKWBZZLFAAGS-UHFFFAOYSA-N
MW288.48 g/mol
LogP4.24
Rot. Bonds5

About N-tert-butyl-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)pentan-1-amine

N-tert-butyl-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)pentan-1-amine (PubChem CID 83039796) has the molecular formula C19H32N2 and a molecular weight of 288.48 g/mol. Its IUPAC name is N-tert-butyl-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)pentan-1-amine.

Molecular Properties

Compound NameN-tert-butyl-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)pentan-1-amine
PubChem CID83039796
Molecular FormulaC19H32N2
Molecular Weight288.48 g/mol
Exact Mass288.26
IUPAC NameN-tert-butyl-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)pentan-1-amine
SMILESCCCC(CNC(C)(C)C)N1CC(C)Cc2ccccc21
InChIInChI=1S/C19H32N2/c1-6-9-17(13-20-19(3,4)5)21-14-15(2)12-16-10-7-8-11-18(16)21/h7-8,10-11,15,17,20H,6,9,12-14H2,1-5H3
InChIKeyLKXKWBZZLFAAGS-UHFFFAOYSA-N
XLogP4.24
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.48
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-tert-butyl-2-(2,3-dihydroindol-1-yl)pentan-1-amine
CID 83043122
N-tert-butyl-2-(2-methyl-2,3-dihydroindol-1-yl)butan-1-amine
CID 62425682
2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)nonan-1-amine
CID 63466877
4-amino-3-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-N-propylbutanamide
CID 66426549
N-tert-butyl-4-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)butan-1-amine
CID 63492799
2-methyl-1-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)pentan-2-amine
CID 55222667
2-(3,4-dihydro-2H-quinolin-1-yl)-N-ethylpentan-1-amine
CID 83043322
3,3,3-trifluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)propan-1-amine
CID 63403968
4-amino-N-methyl-3-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)butanamide
CID 66426715
3,3-dimethyl-1-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)butan-2-ol
CID 55192460
(3S)-1,3-dimethyl-3,4-dihydro-2H-quinoline
CID 40526138
(2R)-1-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)pentan-2-amine
CID 112736704

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)pentan-1-amine?
The IUPAC name of N-tert-butyl-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)pentan-1-amine (CID 83039796) is N-tert-butyl-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)pentan-1-amine.
What is the SMILES notation for N-tert-butyl-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)pentan-1-amine?
The canonical SMILES for N-tert-butyl-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)pentan-1-amine is CCCC(CNC(C)(C)C)N1CC(C)Cc2ccccc21.
What is the InChIKey of N-tert-butyl-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)pentan-1-amine?
The InChIKey is LKXKWBZZLFAAGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32N2/c1-6-9-17(13-20-19(3,4)5)21-14-15(2)12-16-10-7-8-11-18(16)21/h7-8,10-11,15,17,20H,6,9,12-14H2,1-5H3.
What are the key properties of N-tert-butyl-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)pentan-1-amine?
N-tert-butyl-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)pentan-1-amine has a molecular weight of 288.48 g/mol, XLogP of 4.24, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)pentan-1-amine is sourced from PubChem (CID 83039796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).