N-(3,3,5,5-tetramethylcyclohexyl)quinolin-2-amine

C19H26N2 — CID 103967142

IUPACN-(3,3,5,5-tetramethylcyclohexyl)quinolin-2-amine
SMILESCC1(C)CC(Nc2ccc3ccccc3n2)CC(C)(C)C1
InChIInChI=1S/C19H26N2/c1-18(2)11-15(12-19(3,4)13-18)20-17-10-9-14-7-5-6-8-16(14)21-17/h5-10,15H,11-13H2,1-4H3,(H,20,21)
InChIKeyZILFUFBVRBGPCE-UHFFFAOYSA-N
MW282.43 g/mol
LogP5.25
Rot. Bonds2

About N-(3,3,5,5-tetramethylcyclohexyl)quinolin-2-amine

N-(3,3,5,5-tetramethylcyclohexyl)quinolin-2-amine (PubChem CID 103967142) has the molecular formula C19H26N2 and a molecular weight of 282.43 g/mol. Its IUPAC name is N-(3,3,5,5-tetramethylcyclohexyl)quinolin-2-amine.

Molecular Properties

Compound NameN-(3,3,5,5-tetramethylcyclohexyl)quinolin-2-amine
PubChem CID103967142
Molecular FormulaC19H26N2
Molecular Weight282.43 g/mol
Exact Mass282.21
IUPAC NameN-(3,3,5,5-tetramethylcyclohexyl)quinolin-2-amine
SMILESCC1(C)CC(Nc2ccc3ccccc3n2)CC(C)(C)C1
InChIInChI=1S/C19H26N2/c1-18(2)11-15(12-19(3,4)13-18)20-17-10-9-14-7-5-6-8-16(14)21-17/h5-10,15H,11-13H2,1-4H3,(H,20,21)
InChIKeyZILFUFBVRBGPCE-UHFFFAOYSA-N
XLogP5.25
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500282.43
LogP ≤ 55.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-N-methyl-4-N-quinolin-2-ylcyclohexane-1,4-diamine
CID 23026816
N-(2,2-dimethyloxan-4-yl)quinolin-2-amine
CID 115563852
N-(1-ethylpiperidin-4-yl)quinolin-2-amine
CID 60666937
6-N-methyl-4-N-(3,3,5,5-tetramethylcyclohexyl)pyrimidine-4,6-diamine
CID 103968628
5-fluoro-N-(3,3,5,5-tetramethylcyclohexyl)pyridin-2-amine
CID 103967192
N-(1,2,3,4-tetrahydronaphthalen-2-yl)quinolin-2-amine
CID 60631928
N-(3,3,5,5-tetramethylcyclohexyl)phthalazin-1-amine
CID 103967080
6-methoxy-2-methyl-N-(3,3,5,5-tetramethylcyclohexyl)pyrimidin-4-amine
CID 103967188
N-(9H-fluoren-9-yl)quinolin-2-amine
CID 175346330
trans-(1R,2R)-2-(quinolin-2-ylamino)cyclopentan-1-ol
CID 99857876
N-(2-phenyloxan-4-yl)quinolin-2-amine
CID 133474130
N-(3,3-dimethylcyclobutyl)-4-methylpyridin-2-amine
CID 131047920

Frequently Asked Questions

What is the IUPAC name of N-(3,3,5,5-tetramethylcyclohexyl)quinolin-2-amine?
The IUPAC name of N-(3,3,5,5-tetramethylcyclohexyl)quinolin-2-amine (CID 103967142) is N-(3,3,5,5-tetramethylcyclohexyl)quinolin-2-amine.
What is the SMILES notation for N-(3,3,5,5-tetramethylcyclohexyl)quinolin-2-amine?
The canonical SMILES for N-(3,3,5,5-tetramethylcyclohexyl)quinolin-2-amine is CC1(C)CC(Nc2ccc3ccccc3n2)CC(C)(C)C1.
What is the InChIKey of N-(3,3,5,5-tetramethylcyclohexyl)quinolin-2-amine?
The InChIKey is ZILFUFBVRBGPCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2/c1-18(2)11-15(12-19(3,4)13-18)20-17-10-9-14-7-5-6-8-16(14)21-17/h5-10,15H,11-13H2,1-4H3,(H,20,21).
What are the key properties of N-(3,3,5,5-tetramethylcyclohexyl)quinolin-2-amine?
N-(3,3,5,5-tetramethylcyclohexyl)quinolin-2-amine has a molecular weight of 282.43 g/mol, XLogP of 5.25, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3,5,5-tetramethylcyclohexyl)quinolin-2-amine is sourced from PubChem (CID 103967142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).