N-(2,2-dimethylcyclohexyl)-5,6,7,8-tetrahydronaphthalen-1-amine

C18H27N — CID 79829071

IUPACN-(2,2-dimethylcyclohexyl)-5,6,7,8-tetrahydronaphthalen-1-amine
SMILESCC1(C)CCCCC1Nc1cccc2c1CCCC2
InChIInChI=1S/C18H27N/c1-18(2)13-6-5-12-17(18)19-16-11-7-9-14-8-3-4-10-15(14)16/h7,9,11,17,19H,3-6,8,10,12-13H2,1-2H3
InChIKeyNLMHKADMSGBZNG-UHFFFAOYSA-N
MW257.42 g/mol
LogP4.95
Rot. Bonds2

About N-(2,2-dimethylcyclohexyl)-5,6,7,8-tetrahydronaphthalen-1-amine

N-(2,2-dimethylcyclohexyl)-5,6,7,8-tetrahydronaphthalen-1-amine (PubChem CID 79829071) has the molecular formula C18H27N and a molecular weight of 257.42 g/mol. Its IUPAC name is N-(2,2-dimethylcyclohexyl)-5,6,7,8-tetrahydronaphthalen-1-amine.

Molecular Properties

Compound NameN-(2,2-dimethylcyclohexyl)-5,6,7,8-tetrahydronaphthalen-1-amine
PubChem CID79829071
Molecular FormulaC18H27N
Molecular Weight257.42 g/mol
Exact Mass257.21
IUPAC NameN-(2,2-dimethylcyclohexyl)-5,6,7,8-tetrahydronaphthalen-1-amine
SMILESCC1(C)CCCCC1Nc1cccc2c1CCCC2
InChIInChI=1S/C18H27N/c1-18(2)13-6-5-12-17(18)19-16-11-7-9-14-8-3-4-10-15(14)16/h7,9,11,17,19H,3-6,8,10,12-13H2,1-2H3
InChIKeyNLMHKADMSGBZNG-UHFFFAOYSA-N
XLogP4.95
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.42
LogP ≤ 54.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2,2-dimethylcyclohexyl)-2-fluoro-3-methylaniline
CID 114254485
N-(2,2-dimethylcyclohexyl)-2-fluoroaniline
CID 79828760
N-cyclopropyl-2,3-dihydro-1H-inden-4-amine
CID 91150156
3-N-(2,2-dimethylcyclohexyl)pyridine-2,3-diamine
CID 104540565
N-(2,2-dimethylcyclohexyl)-1H-indazol-7-amine
CID 79834912
2-bromo-6-[(2,2-dimethylcyclohexyl)amino]benzonitrile
CID 114881190
N-(2,2-dimethylcyclohexyl)-2-(methoxymethyl)aniline
CID 79828961
N-(2,2-dimethylcyclopentyl)-2-methylsulfanylaniline
CID 79859896
N-(2,2-dimethylcyclohexyl)-5-fluoro-2-methylaniline
CID 79829574
1-N-(2,2-dimethylcyclohexyl)-2-methylbenzene-1,4-diamine
CID 79861808
1-methyl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)azepan-4-amine
CID 65071434
N-(2,2-dimethylcyclohexyl)-2-(trifluoromethylsulfanyl)aniline
CID 79829200

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethylcyclohexyl)-5,6,7,8-tetrahydronaphthalen-1-amine?
The IUPAC name of N-(2,2-dimethylcyclohexyl)-5,6,7,8-tetrahydronaphthalen-1-amine (CID 79829071) is N-(2,2-dimethylcyclohexyl)-5,6,7,8-tetrahydronaphthalen-1-amine.
What is the SMILES notation for N-(2,2-dimethylcyclohexyl)-5,6,7,8-tetrahydronaphthalen-1-amine?
The canonical SMILES for N-(2,2-dimethylcyclohexyl)-5,6,7,8-tetrahydronaphthalen-1-amine is CC1(C)CCCCC1Nc1cccc2c1CCCC2.
What is the InChIKey of N-(2,2-dimethylcyclohexyl)-5,6,7,8-tetrahydronaphthalen-1-amine?
The InChIKey is NLMHKADMSGBZNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N/c1-18(2)13-6-5-12-17(18)19-16-11-7-9-14-8-3-4-10-15(14)16/h7,9,11,17,19H,3-6,8,10,12-13H2,1-2H3.
What are the key properties of N-(2,2-dimethylcyclohexyl)-5,6,7,8-tetrahydronaphthalen-1-amine?
N-(2,2-dimethylcyclohexyl)-5,6,7,8-tetrahydronaphthalen-1-amine has a molecular weight of 257.42 g/mol, XLogP of 4.95, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethylcyclohexyl)-5,6,7,8-tetrahydronaphthalen-1-amine is sourced from PubChem (CID 79829071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).