3-methyl-N-propyl-1-quinolin-4-ylhexan-1-amine

C19H28N2 — CID 105137955

IUPAC3-methyl-N-propyl-1-quinolin-4-ylhexan-1-amine
SMILESCCCNC(CC(C)CCC)c1ccnc2ccccc12
InChIInChI=1S/C19H28N2/c1-4-8-15(3)14-19(20-12-5-2)17-11-13-21-18-10-7-6-9-16(17)18/h6-7,9-11,13,15,19-20H,4-5,8,12,14H2,1-3H3
InChIKeyUSAJSBONSKMAJO-UHFFFAOYSA-N
MW284.45 g/mol
LogP5.10
Rot. Bonds8

About 3-methyl-N-propyl-1-quinolin-4-ylhexan-1-amine

3-methyl-N-propyl-1-quinolin-4-ylhexan-1-amine (PubChem CID 105137955) has the molecular formula C19H28N2 and a molecular weight of 284.45 g/mol. Its IUPAC name is 3-methyl-N-propyl-1-quinolin-4-ylhexan-1-amine.

Molecular Properties

Compound Name3-methyl-N-propyl-1-quinolin-4-ylhexan-1-amine
PubChem CID105137955
Molecular FormulaC19H28N2
Molecular Weight284.45 g/mol
Exact Mass284.23
IUPAC Name3-methyl-N-propyl-1-quinolin-4-ylhexan-1-amine
SMILESCCCNC(CC(C)CCC)c1ccnc2ccccc12
InChIInChI=1S/C19H28N2/c1-4-8-15(3)14-19(20-12-5-2)17-11-13-21-18-10-7-6-9-16(17)18/h6-7,9-11,13,15,19-20H,4-5,8,12,14H2,1-3H3
InChIKeyUSAJSBONSKMAJO-UHFFFAOYSA-N
XLogP5.10
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500284.45
LogP ≤ 55.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-quinolin-4-yl-2-(1,3-thiazol-2-yl)ethyl]propan-1-amine
CID 105169168
N-propyl-2-quinolin-4-ylpentan-3-amine
CID 63560165
3-methyl-1-(2-methylphenyl)-N-propylhexan-1-amine
CID 63413299
N-methyl-1-quinolin-4-yloctan-1-amine
CID 105124579
3-methyl-1-(2-methyl-4-pyridinyl)-N-propylhexan-1-amine
CID 106755154
1-(2,6-dimethyl-3-pyridinyl)-3-methyl-N-propylhexan-1-amine
CID 105137878
1-(4-chloronaphthalen-1-yl)-3-methyl-N-propylpentan-1-amine
CID 114874516
N-[oxan-4-yl(quinolin-4-yl)methyl]propan-1-amine
CID 105147197
3-methyl-1-quinolin-4-ylpentan-1-ol
CID 65149770
1-(3-bromo-2-methylphenyl)-3-methyl-N-propylhexan-1-amine
CID 115845363
1-isoquinolin-1-yl-N,3-dimethylhexan-1-amine
CID 63948446
3-methyl-1-naphthalen-1-yl-N-propylbutan-1-amine
CID 55188123

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-propyl-1-quinolin-4-ylhexan-1-amine?
The IUPAC name of 3-methyl-N-propyl-1-quinolin-4-ylhexan-1-amine (CID 105137955) is 3-methyl-N-propyl-1-quinolin-4-ylhexan-1-amine.
What is the SMILES notation for 3-methyl-N-propyl-1-quinolin-4-ylhexan-1-amine?
The canonical SMILES for 3-methyl-N-propyl-1-quinolin-4-ylhexan-1-amine is CCCNC(CC(C)CCC)c1ccnc2ccccc12.
What is the InChIKey of 3-methyl-N-propyl-1-quinolin-4-ylhexan-1-amine?
The InChIKey is USAJSBONSKMAJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2/c1-4-8-15(3)14-19(20-12-5-2)17-11-13-21-18-10-7-6-9-16(17)18/h6-7,9-11,13,15,19-20H,4-5,8,12,14H2,1-3H3.
What are the key properties of 3-methyl-N-propyl-1-quinolin-4-ylhexan-1-amine?
3-methyl-N-propyl-1-quinolin-4-ylhexan-1-amine has a molecular weight of 284.45 g/mol, XLogP of 5.10, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-propyl-1-quinolin-4-ylhexan-1-amine is sourced from PubChem (CID 105137955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).