N-[2-(4-cyclohexylpiperidin-1-yl)ethyl]-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine

C24H38N2O — CID 44598190

IUPACN-[2-(4-cyclohexylpiperidin-1-yl)ethyl]-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCOc1cccc2c1CCCC2NCCN1CCC(C2CCCCC2)CC1
InChIInChI=1S/C24H38N2O/c1-27-24-12-6-9-21-22(24)10-5-11-23(21)25-15-18-26-16-13-20(14-17-26)19-7-3-2-4-8-19/h6,9,12,19-20,23,25H,2-5,7-8,10-11,13-18H2,1H3
InChIKeyLXALVNKDBHLWFP-UHFFFAOYSA-N
MW370.58 g/mol
LogP4.95
Rot. Bonds6

About N-[2-(4-cyclohexylpiperidin-1-yl)ethyl]-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine

N-[2-(4-cyclohexylpiperidin-1-yl)ethyl]-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine (PubChem CID 44598190) has the molecular formula C24H38N2O and a molecular weight of 370.58 g/mol. Its IUPAC name is N-[2-(4-cyclohexylpiperidin-1-yl)ethyl]-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine.

Molecular Properties

Compound NameN-[2-(4-cyclohexylpiperidin-1-yl)ethyl]-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
PubChem CID44598190
Molecular FormulaC24H38N2O
Molecular Weight370.58 g/mol
Exact Mass370.30
IUPAC NameN-[2-(4-cyclohexylpiperidin-1-yl)ethyl]-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCOc1cccc2c1CCCC2NCCN1CCC(C2CCCCC2)CC1
InChIInChI=1S/C24H38N2O/c1-27-24-12-6-9-21-22(24)10-5-11-23(21)25-15-18-26-16-13-20(14-17-26)19-7-3-2-4-8-19/h6,9,12,19-20,23,25H,2-5,7-8,10-11,13-18H2,1H3
InChIKeyLXALVNKDBHLWFP-UHFFFAOYSA-N
XLogP4.95
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.58
LogP ≤ 54.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[2-(4-cyclohexylpiperidin-1-yl)ethyl]-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine with MolForge

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Related Compounds

CP 96345
CID 104943
Ezlopitant
CID 188927
AJ 76
CID 122334
1-Cyclohexyl-4-(3-(5-methoxy-1,2,3,4-tetrahydro-naphthalen-1-yl)-propyl)-piperazine
CID 10474335
CP-100263
CID 9796216
CP-99994
CID 5311057
(2-Benzhydryl-1-aza-bicyclo[2.2.2]oct-3-yl)-(2-methoxy-benzyl)-amine
CID 14986135
1-Cyclohexyl-4-[3-((R)-5-methoxy-1,2,3,4-tetrahydro-naphthalen-1-yl)-propyl]-piperazine
CID 11152920
1-(2-(2-Ethoxyphenyl)-1-phenylethyl)piperazine
CID 11289879
1-(2-(3-Methoxyphenyl)-1-phenylethyl)piperazine
CID 13904719
1-(2-(2-Methoxyphenyl)-1-phenylethyl)piperazine
CID 44414722
1-(1-Phenyl-2-(2-propoxyphenyl)ethyl)piperazine
CID 44414723

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-cyclohexylpiperidin-1-yl)ethyl]-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine?
The IUPAC name of N-[2-(4-cyclohexylpiperidin-1-yl)ethyl]-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine (CID 44598190) is N-[2-(4-cyclohexylpiperidin-1-yl)ethyl]-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine.
What is the SMILES notation for N-[2-(4-cyclohexylpiperidin-1-yl)ethyl]-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine?
The canonical SMILES for N-[2-(4-cyclohexylpiperidin-1-yl)ethyl]-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine is COc1cccc2c1CCCC2NCCN1CCC(C2CCCCC2)CC1.
What is the InChIKey of N-[2-(4-cyclohexylpiperidin-1-yl)ethyl]-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine?
The InChIKey is LXALVNKDBHLWFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H38N2O/c1-27-24-12-6-9-21-22(24)10-5-11-23(21)25-15-18-26-16-13-20(14-17-26)19-7-3-2-4-8-19/h6,9,12,19-20,23,25H,2-5,7-8,10-11,13-18H2,1H3.
What are the key properties of N-[2-(4-cyclohexylpiperidin-1-yl)ethyl]-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine?
N-[2-(4-cyclohexylpiperidin-1-yl)ethyl]-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine has a molecular weight of 370.58 g/mol, XLogP of 4.95, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-cyclohexylpiperidin-1-yl)ethyl]-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine is sourced from PubChem (CID 44598190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).