7-N-ethyl-2-N,2-N-dipropyl-1,2,3,4-tetrahydronaphthalene-2,7-diamine

C18H30N2 — CID 14798947

IUPAC7-N-ethyl-2-N,2-N-dipropyl-1,2,3,4-tetrahydronaphthalene-2,7-diamine
SMILESCCCN(CCC)C1CCc2ccc(NCC)cc2C1
InChIInChI=1S/C18H30N2/c1-4-11-20(12-5-2)18-10-8-15-7-9-17(19-6-3)13-16(15)14-18/h7,9,13,18-19H,4-6,8,10-12,14H2,1-3H3
InChIKeyVDDDKUMSXUSMBN-UHFFFAOYSA-N
MW274.45 g/mol
LogP4.10
Rot. Bonds7

About 7-N-ethyl-2-N,2-N-dipropyl-1,2,3,4-tetrahydronaphthalene-2,7-diamine

7-N-ethyl-2-N,2-N-dipropyl-1,2,3,4-tetrahydronaphthalene-2,7-diamine (PubChem CID 14798947) has the molecular formula C18H30N2 and a molecular weight of 274.45 g/mol. Its IUPAC name is 7-N-ethyl-2-N,2-N-dipropyl-1,2,3,4-tetrahydronaphthalene-2,7-diamine.

Molecular Properties

Compound Name7-N-ethyl-2-N,2-N-dipropyl-1,2,3,4-tetrahydronaphthalene-2,7-diamine
PubChem CID14798947
Molecular FormulaC18H30N2
Molecular Weight274.45 g/mol
Exact Mass274.24
IUPAC Name7-N-ethyl-2-N,2-N-dipropyl-1,2,3,4-tetrahydronaphthalene-2,7-diamine
SMILESCCCN(CCC)C1CCc2ccc(NCC)cc2C1
InChIInChI=1S/C18H30N2/c1-4-11-20(12-5-2)18-10-8-15-7-9-17(19-6-3)13-16(15)14-18/h7,9,13,18-19H,4-6,8,10-12,14H2,1-3H3
InChIKeyVDDDKUMSXUSMBN-UHFFFAOYSA-N
XLogP4.10
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.45
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(7R)-7-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-2-ol bromide
CID 51371143
6-chloro-N,N-dipropyl-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride
CID 91826447
7-[[(E)-3-iodoprop-2-enyl]-propylamino]-5,6,7,8-tetrahydronaphthalen-2-ol
CID 6305587
3-[propyl(1,2,3,4-tetrahydronaphthalen-2-yl)amino]propanenitrile
CID 47540982
N-[7-[bis(3-phenylpropyl)amino]-5,6,7,8-tetrahydronaphthalen-2-yl]acetamide
CID 54434056
7-[(2-fluoro-2-methoxyethyl)-propylamino]-5,6,7,8-tetrahydronaphthalen-2-ol
CID 91477099
N-(2-methylsulfonylethyl)-N-propyl-1,2,3,4-tetrahydronaphthalen-2-amine
CID 47540985
2-N,2-N-dipropyl-2,3-dihydro-1H-indene-2,5-diamine
CID 10537561
4-[propyl-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]amino]butanenitrile
CID 95172612
7-[propyl(3-thiophen-2-ylpropyl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol
CID 57225664
2-[2-[propyl(1,2,3,4-tetrahydronaphthalen-2-yl)amino]ethoxy]ethanol
CID 111332758
5-methylsulfanyl-N,N-dipropyl-2,3-dihydro-1H-inden-2-amine
CID 19710198

Frequently Asked Questions

What is the IUPAC name of 7-N-ethyl-2-N,2-N-dipropyl-1,2,3,4-tetrahydronaphthalene-2,7-diamine?
The IUPAC name of 7-N-ethyl-2-N,2-N-dipropyl-1,2,3,4-tetrahydronaphthalene-2,7-diamine (CID 14798947) is 7-N-ethyl-2-N,2-N-dipropyl-1,2,3,4-tetrahydronaphthalene-2,7-diamine.
What is the SMILES notation for 7-N-ethyl-2-N,2-N-dipropyl-1,2,3,4-tetrahydronaphthalene-2,7-diamine?
The canonical SMILES for 7-N-ethyl-2-N,2-N-dipropyl-1,2,3,4-tetrahydronaphthalene-2,7-diamine is CCCN(CCC)C1CCc2ccc(NCC)cc2C1.
What is the InChIKey of 7-N-ethyl-2-N,2-N-dipropyl-1,2,3,4-tetrahydronaphthalene-2,7-diamine?
The InChIKey is VDDDKUMSXUSMBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2/c1-4-11-20(12-5-2)18-10-8-15-7-9-17(19-6-3)13-16(15)14-18/h7,9,13,18-19H,4-6,8,10-12,14H2,1-3H3.
What are the key properties of 7-N-ethyl-2-N,2-N-dipropyl-1,2,3,4-tetrahydronaphthalene-2,7-diamine?
7-N-ethyl-2-N,2-N-dipropyl-1,2,3,4-tetrahydronaphthalene-2,7-diamine has a molecular weight of 274.45 g/mol, XLogP of 4.10, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-N-ethyl-2-N,2-N-dipropyl-1,2,3,4-tetrahydronaphthalene-2,7-diamine is sourced from PubChem (CID 14798947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).