N,2-diethyl-2-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]butan-1-amine

C19H32N2 — CID 63484323

IUPACN,2-diethyl-2-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]butan-1-amine
SMILESCCNCC(CC)(CC)CN1CCCc2cc(C)ccc21
InChIInChI=1S/C19H32N2/c1-5-19(6-2,14-20-7-3)15-21-12-8-9-17-13-16(4)10-11-18(17)21/h10-11,13,20H,5-9,12,14-15H2,1-4H3
InChIKeyGEIMCLUVEBSUAP-UHFFFAOYSA-N
MW288.48 g/mol
LogP4.16
Rot. Bonds7

About N,2-diethyl-2-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]butan-1-amine

N,2-diethyl-2-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]butan-1-amine (PubChem CID 63484323) has the molecular formula C19H32N2 and a molecular weight of 288.48 g/mol. Its IUPAC name is N,2-diethyl-2-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]butan-1-amine.

Molecular Properties

Compound NameN,2-diethyl-2-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]butan-1-amine
PubChem CID63484323
Molecular FormulaC19H32N2
Molecular Weight288.48 g/mol
Exact Mass288.26
IUPAC NameN,2-diethyl-2-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]butan-1-amine
SMILESCCNCC(CC)(CC)CN1CCCc2cc(C)ccc21
InChIInChI=1S/C19H32N2/c1-5-19(6-2,14-20-7-3)15-21-12-8-9-17-13-16(4)10-11-18(17)21/h10-11,13,20H,5-9,12,14-15H2,1-4H3
InChIKeyGEIMCLUVEBSUAP-UHFFFAOYSA-N
XLogP4.16
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.48
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,2-diethyl-2-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]butan-1-amine?
The IUPAC name of N,2-diethyl-2-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]butan-1-amine (CID 63484323) is N,2-diethyl-2-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]butan-1-amine.
What is the SMILES notation for N,2-diethyl-2-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]butan-1-amine?
The canonical SMILES for N,2-diethyl-2-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]butan-1-amine is CCNCC(CC)(CC)CN1CCCc2cc(C)ccc21.
What is the InChIKey of N,2-diethyl-2-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]butan-1-amine?
The InChIKey is GEIMCLUVEBSUAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32N2/c1-5-19(6-2,14-20-7-3)15-21-12-8-9-17-13-16(4)10-11-18(17)21/h10-11,13,20H,5-9,12,14-15H2,1-4H3.
What are the key properties of N,2-diethyl-2-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]butan-1-amine?
N,2-diethyl-2-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]butan-1-amine has a molecular weight of 288.48 g/mol, XLogP of 4.16, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-diethyl-2-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]butan-1-amine is sourced from PubChem (CID 63484323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).