2-methyl-N-(3-methylcyclohexyl)quinolin-4-amine

C17H22N2 — CID 43428308

IUPAC2-methyl-N-(3-methylcyclohexyl)quinolin-4-amine
SMILESCc1cc(NC2CCCC(C)C2)c2ccccc2n1
InChIInChI=1S/C17H22N2/c1-12-6-5-7-14(10-12)19-17-11-13(2)18-16-9-4-3-8-15(16)17/h3-4,8-9,11-12,14H,5-7,10H2,1-2H3,(H,18,19)
InChIKeyVGCPQNIVEUKIHB-UHFFFAOYSA-N
MW254.38 g/mol
LogP4.53
Rot. Bonds2

About 2-methyl-N-(3-methylcyclohexyl)quinolin-4-amine

2-methyl-N-(3-methylcyclohexyl)quinolin-4-amine (PubChem CID 43428308) has the molecular formula C17H22N2 and a molecular weight of 254.38 g/mol. Its IUPAC name is 2-methyl-N-(3-methylcyclohexyl)quinolin-4-amine.

Molecular Properties

Compound Name2-methyl-N-(3-methylcyclohexyl)quinolin-4-amine
PubChem CID43428308
Molecular FormulaC17H22N2
Molecular Weight254.38 g/mol
Exact Mass254.18
IUPAC Name2-methyl-N-(3-methylcyclohexyl)quinolin-4-amine
SMILESCc1cc(NC2CCCC(C)C2)c2ccccc2n1
InChIInChI=1S/C17H22N2/c1-12-6-5-7-14(10-12)19-17-11-13(2)18-16-9-4-3-8-15(16)17/h3-4,8-9,11-12,14H,5-7,10H2,1-2H3,(H,18,19)
InChIKeyVGCPQNIVEUKIHB-UHFFFAOYSA-N
XLogP4.53
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.38
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(2-methylquinolin-4-yl)amino]cyclopentane-1-carboxylic acid
CID 66032758
N-(3-methylcyclohexyl)cinnolin-4-amine
CID 63588258
2-methyl-4-N-(3-methylcyclopentyl)quinoline-4,6-diamine
CID 114543215
N-(1-tert-butylpiperidin-4-yl)-2-methylquinolin-4-amine
CID 166183861
2-[4-[(2-methylquinolin-4-yl)amino]piperidin-1-yl]cyclohexan-1-ol
CID 133376301
4,6-dimethyl-N-(3-methylcyclohexyl)pyrimidin-2-amine
CID 43428255
trans-(1R,2R)-2-N-(2-methylquinolin-4-yl)cyclohexane-1,2-diamine
CID 93453736
N-(2-chlorocyclohexyl)-2-methylquinolin-4-amine
CID 65028937
3-methyl-N-(3-methylcyclohexyl)quinolin-2-amine
CID 63535243
2-methyl-N-(1-propylpiperidin-4-yl)quinolin-4-amine
CID 71899433
N-(2,2-dimethylcyclopropyl)-2-methylquinolin-4-amine
CID 61223865
N-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-2-methylquinolin-4-amine
CID 133336114

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(3-methylcyclohexyl)quinolin-4-amine?
The IUPAC name of 2-methyl-N-(3-methylcyclohexyl)quinolin-4-amine (CID 43428308) is 2-methyl-N-(3-methylcyclohexyl)quinolin-4-amine.
What is the SMILES notation for 2-methyl-N-(3-methylcyclohexyl)quinolin-4-amine?
The canonical SMILES for 2-methyl-N-(3-methylcyclohexyl)quinolin-4-amine is Cc1cc(NC2CCCC(C)C2)c2ccccc2n1.
What is the InChIKey of 2-methyl-N-(3-methylcyclohexyl)quinolin-4-amine?
The InChIKey is VGCPQNIVEUKIHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2/c1-12-6-5-7-14(10-12)19-17-11-13(2)18-16-9-4-3-8-15(16)17/h3-4,8-9,11-12,14H,5-7,10H2,1-2H3,(H,18,19).
What are the key properties of 2-methyl-N-(3-methylcyclohexyl)quinolin-4-amine?
2-methyl-N-(3-methylcyclohexyl)quinolin-4-amine has a molecular weight of 254.38 g/mol, XLogP of 4.53, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(3-methylcyclohexyl)quinolin-4-amine is sourced from PubChem (CID 43428308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).