4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-N-propan-2-ylpentan-1-amine

C18H30N2 — CID 62419939

IUPAC4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-N-propan-2-ylpentan-1-amine
SMILESCc1ccc2c(c1)CCCN2C(C)CCCNC(C)C
InChIInChI=1S/C18H30N2/c1-14(2)19-11-5-7-16(4)20-12-6-8-17-13-15(3)9-10-18(17)20/h9-10,13-14,16,19H,5-8,11-12H2,1-4H3
InChIKeyWTIRZTFYPRMEBP-UHFFFAOYSA-N
MW274.45 g/mol
LogP3.91
Rot. Bonds6

About 4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-N-propan-2-ylpentan-1-amine

4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-N-propan-2-ylpentan-1-amine (PubChem CID 62419939) has the molecular formula C18H30N2 and a molecular weight of 274.45 g/mol. Its IUPAC name is 4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-N-propan-2-ylpentan-1-amine.

Molecular Properties

Compound Name4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-N-propan-2-ylpentan-1-amine
PubChem CID62419939
Molecular FormulaC18H30N2
Molecular Weight274.45 g/mol
Exact Mass274.24
IUPAC Name4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-N-propan-2-ylpentan-1-amine
SMILESCc1ccc2c(c1)CCCN2C(C)CCCNC(C)C
InChIInChI=1S/C18H30N2/c1-14(2)19-11-5-7-16(4)20-12-6-8-17-13-15(3)9-10-18(17)20/h9-10,13-14,16,19H,5-8,11-12H2,1-4H3
InChIKeyWTIRZTFYPRMEBP-UHFFFAOYSA-N
XLogP3.91
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.45
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-N-propan-2-ylpentan-1-amine with MolForge

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Related Compounds

N-[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)ethyl]propan-2-amine
CID 60841491
3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)butanethioamide
CID 54945043
N'-hydroxy-3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)butanimidamide
CID 54945506
3-methyl-2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-N-(2-methylpropyl)butan-1-amine
CID 63491180
N-[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)ethyl]butan-2-amine
CID 60854306
(2S)-N-(4-acetamidophenyl)-2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propanamide
CID 8593571
2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)butanoic acid
CID 43808966
2-(3,4-dihydro-2H-quinolin-1-yl)-N-propan-2-ylpropan-1-amine
CID 62425260
4-(3,4-dihydro-2H-quinolin-1-yl)pentan-1-amine
CID 62425766
3-amino-2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propanoic acid
CID 64692920
ethyl 2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)butanoate
CID 64661866
3-[1-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)ethyl]aniline
CID 61263858

Frequently Asked Questions

What is the IUPAC name of 4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-N-propan-2-ylpentan-1-amine?
The IUPAC name of 4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-N-propan-2-ylpentan-1-amine (CID 62419939) is 4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-N-propan-2-ylpentan-1-amine.
What is the SMILES notation for 4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-N-propan-2-ylpentan-1-amine?
The canonical SMILES for 4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-N-propan-2-ylpentan-1-amine is Cc1ccc2c(c1)CCCN2C(C)CCCNC(C)C.
What is the InChIKey of 4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-N-propan-2-ylpentan-1-amine?
The InChIKey is WTIRZTFYPRMEBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2/c1-14(2)19-11-5-7-16(4)20-12-6-8-17-13-15(3)9-10-18(17)20/h9-10,13-14,16,19H,5-8,11-12H2,1-4H3.
What are the key properties of 4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-N-propan-2-ylpentan-1-amine?
4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-N-propan-2-ylpentan-1-amine has a molecular weight of 274.45 g/mol, XLogP of 3.91, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-N-propan-2-ylpentan-1-amine is sourced from PubChem (CID 62419939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).