2-[(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]cyclohexan-1-amine

C17H26N2 — CID 63494357

IUPAC2-[(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]cyclohexan-1-amine
SMILESCC1Cc2ccccc2N(CC2CCCCC2N)C1
InChIInChI=1S/C17H26N2/c1-13-10-14-6-3-5-9-17(14)19(11-13)12-15-7-2-4-8-16(15)18/h3,5-6,9,13,15-16H,2,4,7-8,10-12,18H2,1H3
InChIKeyLORAIPZEPMRDJA-UHFFFAOYSA-N
MW258.41 g/mol
LogP3.20
Rot. Bonds2

About 2-[(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]cyclohexan-1-amine

2-[(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]cyclohexan-1-amine (PubChem CID 63494357) has the molecular formula C17H26N2 and a molecular weight of 258.41 g/mol. Its IUPAC name is 2-[(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name2-[(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]cyclohexan-1-amine
PubChem CID63494357
Molecular FormulaC17H26N2
Molecular Weight258.41 g/mol
Exact Mass258.21
IUPAC Name2-[(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]cyclohexan-1-amine
SMILESCC1Cc2ccccc2N(CC2CCCCC2N)C1
InChIInChI=1S/C17H26N2/c1-13-10-14-6-3-5-9-17(14)19(11-13)12-15-7-2-4-8-16(15)18/h3,5-6,9,13,15-16H,2,4,7-8,10-12,18H2,1H3
InChIKeyLORAIPZEPMRDJA-UHFFFAOYSA-N
XLogP3.20
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]oxan-4-amine
CID 103060116
2,2-dimethyl-6-[(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]cyclohexan-1-ol
CID 79843525
3-methyl-1-(piperidin-3-ylmethyl)-3,4-dihydro-2H-quinoline
CID 63524793
N-methyl-3-[(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]oxan-4-amine
CID 103060120
4-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)butan-2-amine
CID 63468992
2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)acetonitrile
CID 15304197
1-(2,3-dihydro-1-benzothiophen-3-ylmethyl)-3-methyl-3,4-dihydro-2H-quinoline
CID 79312047
1-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)propan-2-ol
CID 63404059
5-[(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]oxolane-2-carbohydrazide
CID 63572269
5-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)pentan-1-amine
CID 63404154
N-[3-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)propyl]cyclohexanamine
CID 63502793
1-amino-4-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)butan-2-ol
CID 64818927

Frequently Asked Questions

What is the IUPAC name of 2-[(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]cyclohexan-1-amine?
The IUPAC name of 2-[(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]cyclohexan-1-amine (CID 63494357) is 2-[(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]cyclohexan-1-amine.
What is the SMILES notation for 2-[(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]cyclohexan-1-amine?
The canonical SMILES for 2-[(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]cyclohexan-1-amine is CC1Cc2ccccc2N(CC2CCCCC2N)C1.
What is the InChIKey of 2-[(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]cyclohexan-1-amine?
The InChIKey is LORAIPZEPMRDJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2/c1-13-10-14-6-3-5-9-17(14)19(11-13)12-15-7-2-4-8-16(15)18/h3,5-6,9,13,15-16H,2,4,7-8,10-12,18H2,1H3.
What are the key properties of 2-[(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]cyclohexan-1-amine?
2-[(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]cyclohexan-1-amine has a molecular weight of 258.41 g/mol, XLogP of 3.20, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]cyclohexan-1-amine is sourced from PubChem (CID 63494357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).