2,2-dimethyl-1-(quinolin-4-ylmethyl)cyclohexan-1-amine

C18H24N2 — CID 79834580

IUPAC2,2-dimethyl-1-(quinolin-4-ylmethyl)cyclohexan-1-amine
SMILESCC1(C)CCCCC1(N)Cc1ccnc2ccccc12
InChIInChI=1S/C18H24N2/c1-17(2)10-5-6-11-18(17,19)13-14-9-12-20-16-8-4-3-7-15(14)16/h3-4,7-9,12H,5-6,10-11,13,19H2,1-2H3
InChIKeyFVDVGKZCORQEOI-UHFFFAOYSA-N
MW268.40 g/mol
LogP4.07
Rot. Bonds2

About 2,2-dimethyl-1-(quinolin-4-ylmethyl)cyclohexan-1-amine

2,2-dimethyl-1-(quinolin-4-ylmethyl)cyclohexan-1-amine (PubChem CID 79834580) has the molecular formula C18H24N2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 2,2-dimethyl-1-(quinolin-4-ylmethyl)cyclohexan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-1-(quinolin-4-ylmethyl)cyclohexan-1-amine
PubChem CID79834580
Molecular FormulaC18H24N2
Molecular Weight268.40 g/mol
Exact Mass268.19
IUPAC Name2,2-dimethyl-1-(quinolin-4-ylmethyl)cyclohexan-1-amine
SMILESCC1(C)CCCCC1(N)Cc1ccnc2ccccc12
InChIInChI=1S/C18H24N2/c1-17(2)10-5-6-11-18(17,19)13-14-9-12-20-16-8-4-3-7-15(14)16/h3-4,7-9,12H,5-6,10-11,13,19H2,1-2H3
InChIKeyFVDVGKZCORQEOI-UHFFFAOYSA-N
XLogP4.07
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-benzyl-2,2-dimethylcyclohexan-1-amine
CID 79836797
1-[(2-methoxyphenyl)methyl]-2,2-dimethylcyclohexan-1-amine
CID 79834373
1-(quinolin-4-ylmethyl)cycloheptane-1-carboxylic acid
CID 79423213
buta-1,3-diene;2-(quinolin-4-ylmethyl)pyrrolidin-2-amine
CID 143653496
1-benzyl-2,2-dimethylcyclopentan-1-amine
CID 79857228
N-ethyl-1-(1-methylcyclopentyl)-2-quinolin-4-ylethanamine
CID 104997457
3-fluoro-3-(quinolin-4-ylmethyl)cyclohexan-1-amine
CID 112567479
1-(1-ethoxycyclopentyl)-2-quinolin-4-ylethanamine
CID 116761616
1-[1-(aminomethyl)cyclohexyl]-2-quinolin-4-ylethanone
CID 116600615
2-quinolin-4-yl-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine
CID 104997388
[1-(2,2-dimethylcyclopentyl)-2-quinolin-4-ylethyl]hydrazine
CID 107194203
3,3-dimethyl-N-(quinolin-4-ylmethyl)cyclohexan-1-amine
CID 81435291

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-1-(quinolin-4-ylmethyl)cyclohexan-1-amine?
The IUPAC name of 2,2-dimethyl-1-(quinolin-4-ylmethyl)cyclohexan-1-amine (CID 79834580) is 2,2-dimethyl-1-(quinolin-4-ylmethyl)cyclohexan-1-amine.
What is the SMILES notation for 2,2-dimethyl-1-(quinolin-4-ylmethyl)cyclohexan-1-amine?
The canonical SMILES for 2,2-dimethyl-1-(quinolin-4-ylmethyl)cyclohexan-1-amine is CC1(C)CCCCC1(N)Cc1ccnc2ccccc12.
What is the InChIKey of 2,2-dimethyl-1-(quinolin-4-ylmethyl)cyclohexan-1-amine?
The InChIKey is FVDVGKZCORQEOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2/c1-17(2)10-5-6-11-18(17,19)13-14-9-12-20-16-8-4-3-7-15(14)16/h3-4,7-9,12H,5-6,10-11,13,19H2,1-2H3.
What are the key properties of 2,2-dimethyl-1-(quinolin-4-ylmethyl)cyclohexan-1-amine?
2,2-dimethyl-1-(quinolin-4-ylmethyl)cyclohexan-1-amine has a molecular weight of 268.40 g/mol, XLogP of 4.07, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-1-(quinolin-4-ylmethyl)cyclohexan-1-amine is sourced from PubChem (CID 79834580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).