7-chloro-4,5,8-trimethyl-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine

C16H24ClN — CID 115417705

IUPAC7-chloro-4,5,8-trimethyl-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCCCNC1CCC(C)c2c(C)cc(Cl)c(C)c21
InChIInChI=1S/C16H24ClN/c1-5-8-18-14-7-6-10(2)15-11(3)9-13(17)12(4)16(14)15/h9-10,14,18H,5-8H2,1-4H3
InChIKeyWYUVTGDMDOZXTQ-UHFFFAOYSA-N
MW265.83 g/mol
LogP4.89
Rot. Bonds3

About 7-chloro-4,5,8-trimethyl-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine

7-chloro-4,5,8-trimethyl-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine (PubChem CID 115417705) has the molecular formula C16H24ClN and a molecular weight of 265.83 g/mol. Its IUPAC name is 7-chloro-4,5,8-trimethyl-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine.

Molecular Properties

Compound Name7-chloro-4,5,8-trimethyl-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine
PubChem CID115417705
Molecular FormulaC16H24ClN
Molecular Weight265.83 g/mol
Exact Mass265.16
IUPAC Name7-chloro-4,5,8-trimethyl-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCCCNC1CCC(C)c2c(C)cc(Cl)c(C)c21
InChIInChI=1S/C16H24ClN/c1-5-8-18-14-7-6-10(2)15-11(3)9-13(17)12(4)16(14)15/h9-10,14,18H,5-8H2,1-4H3
InChIKeyWYUVTGDMDOZXTQ-UHFFFAOYSA-N
XLogP4.89
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.83
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

7-bromo-4,5,8-trimethyl-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 113305812
(1S)-7-chloro-4,5,8-trimethyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115417703
(1R)-7-chloro-4,5,8-trimethyl-1,2,3,4-tetrahydronaphthalen-1-ol
CID 115417912
N-ethyl-4,5,8-trimethyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115417478
7-chloro-4-methyl-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115417608
1,3-difluoro-4-methyl-N-propyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 79732480
7-bromo-N,4,5,8-tetramethyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115417695
5,6,7-trimethoxy-4-methyl-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115417654
7-bromo-8-methyl-N-propyl-3,4,8,9,10,11-hexahydro-2H-benzo[i][1,5]benzodioxepin-11-amine
CID 115417484
1-chloro-3,4-difluoro-N-propyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 107477722
7-ethyl-4-methyl-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 113305796
7-chloro-4,5,8-trimethyl-3,4-dihydro-2H-naphthalen-1-one
CID 115417433

Frequently Asked Questions

What is the IUPAC name of 7-chloro-4,5,8-trimethyl-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine?
The IUPAC name of 7-chloro-4,5,8-trimethyl-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine (CID 115417705) is 7-chloro-4,5,8-trimethyl-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine.
What is the SMILES notation for 7-chloro-4,5,8-trimethyl-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine?
The canonical SMILES for 7-chloro-4,5,8-trimethyl-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine is CCCNC1CCC(C)c2c(C)cc(Cl)c(C)c21.
What is the InChIKey of 7-chloro-4,5,8-trimethyl-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine?
The InChIKey is WYUVTGDMDOZXTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24ClN/c1-5-8-18-14-7-6-10(2)15-11(3)9-13(17)12(4)16(14)15/h9-10,14,18H,5-8H2,1-4H3.
What are the key properties of 7-chloro-4,5,8-trimethyl-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine?
7-chloro-4,5,8-trimethyl-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine has a molecular weight of 265.83 g/mol, XLogP of 4.89, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-4,5,8-trimethyl-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine is sourced from PubChem (CID 115417705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).