2-N-[1-(dimethylamino)propan-2-yl]-2-N-ethyl-1,2,3,4-tetrahydronaphthalene-1,2-diamine

C17H29N3 — CID 103188495

IUPAC2-N-[1-(dimethylamino)propan-2-yl]-2-N-ethyl-1,2,3,4-tetrahydronaphthalene-1,2-diamine
SMILESCCN(C(C)CN(C)C)C1CCc2ccccc2C1N
InChIInChI=1S/C17H29N3/c1-5-20(13(2)12-19(3)4)16-11-10-14-8-6-7-9-15(14)17(16)18/h6-9,13,16-17H,5,10-12,18H2,1-4H3
InChIKeyLFPQQZMLIBJHER-UHFFFAOYSA-N
MW275.44 g/mol
LogP2.27
Rot. Bonds5

About 2-N-[1-(dimethylamino)propan-2-yl]-2-N-ethyl-1,2,3,4-tetrahydronaphthalene-1,2-diamine

2-N-[1-(dimethylamino)propan-2-yl]-2-N-ethyl-1,2,3,4-tetrahydronaphthalene-1,2-diamine (PubChem CID 103188495) has the molecular formula C17H29N3 and a molecular weight of 275.44 g/mol. Its IUPAC name is 2-N-[1-(dimethylamino)propan-2-yl]-2-N-ethyl-1,2,3,4-tetrahydronaphthalene-1,2-diamine.

Molecular Properties

Compound Name2-N-[1-(dimethylamino)propan-2-yl]-2-N-ethyl-1,2,3,4-tetrahydronaphthalene-1,2-diamine
PubChem CID103188495
Molecular FormulaC17H29N3
Molecular Weight275.44 g/mol
Exact Mass275.24
IUPAC Name2-N-[1-(dimethylamino)propan-2-yl]-2-N-ethyl-1,2,3,4-tetrahydronaphthalene-1,2-diamine
SMILESCCN(C(C)CN(C)C)C1CCc2ccccc2C1N
InChIInChI=1S/C17H29N3/c1-5-20(13(2)12-19(3)4)16-11-10-14-8-6-7-9-15(14)17(16)18/h6-9,13,16-17H,5,10-12,18H2,1-4H3
InChIKeyLFPQQZMLIBJHER-UHFFFAOYSA-N
XLogP2.27
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.44
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-N-[1-(dimethylamino)propan-2-yl]-2-N-ethyl-1,2,3,4-tetrahydronaphthalene-1,2-diamine with MolForge

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Related Compounds

2-N-(2-methylpropyl)-2-N-propan-2-yl-1,2,3,4-tetrahydronaphthalene-1,2-diamine
CID 54999713
2-N-methyl-2-N-(2-methylbutyl)-1,2,3,4-tetrahydronaphthalene-1,2-diamine
CID 43295683
2-N-methyl-2-N-(2-methylbutan-2-yl)-1,2,3,4-tetrahydronaphthalene-1,2-diamine
CID 63980779
2-N-cyclopropyl-2-N-ethyl-1,2,3,4-tetrahydronaphthalene-1,2-diamine
CID 43264128
6-N-butan-2-yl-6-N-methyl-6,7,8,9-tetrahydro-5H-benzo[7]annulene-5,6-diamine
CID 43272852
2-N-ethyl-2-N-(2-methoxyethyl)-1,2,3,4-tetrahydronaphthalene-1,2-diamine
CID 61447898
6-N-ethyl-6-N-propyl-6,7,8,9-tetrahydro-5H-benzo[7]annulene-5,6-diamine
CID 43268680
(2S)-N,N,2-trimethyl-3-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenyl)propan-1-amine;hydrochloride
CID 76961165
2-N-methyl-2-N-(3-methylbutan-2-yl)-1-N-propyl-1,2,3,4-tetrahydronaphthalene-1,2-diamine
CID 63469194
6-N-(2-ethoxyethyl)-6-N-methyl-6,7,8,9-tetrahydro-5H-benzo[7]annulene-5,6-diamine
CID 81058338
5-[1-(dimethylamino)propan-2-yl-ethylamino]-5,6,7,8-tetrahydronaphthalen-1-ol
CID 103192654
2-N-cyclopentyl-2-N-ethyl-2,3-dihydro-1H-indene-1,2-diamine
CID 43541072

Frequently Asked Questions

What is the IUPAC name of 2-N-[1-(dimethylamino)propan-2-yl]-2-N-ethyl-1,2,3,4-tetrahydronaphthalene-1,2-diamine?
The IUPAC name of 2-N-[1-(dimethylamino)propan-2-yl]-2-N-ethyl-1,2,3,4-tetrahydronaphthalene-1,2-diamine (CID 103188495) is 2-N-[1-(dimethylamino)propan-2-yl]-2-N-ethyl-1,2,3,4-tetrahydronaphthalene-1,2-diamine.
What is the SMILES notation for 2-N-[1-(dimethylamino)propan-2-yl]-2-N-ethyl-1,2,3,4-tetrahydronaphthalene-1,2-diamine?
The canonical SMILES for 2-N-[1-(dimethylamino)propan-2-yl]-2-N-ethyl-1,2,3,4-tetrahydronaphthalene-1,2-diamine is CCN(C(C)CN(C)C)C1CCc2ccccc2C1N.
What is the InChIKey of 2-N-[1-(dimethylamino)propan-2-yl]-2-N-ethyl-1,2,3,4-tetrahydronaphthalene-1,2-diamine?
The InChIKey is LFPQQZMLIBJHER-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3/c1-5-20(13(2)12-19(3)4)16-11-10-14-8-6-7-9-15(14)17(16)18/h6-9,13,16-17H,5,10-12,18H2,1-4H3.
What are the key properties of 2-N-[1-(dimethylamino)propan-2-yl]-2-N-ethyl-1,2,3,4-tetrahydronaphthalene-1,2-diamine?
2-N-[1-(dimethylamino)propan-2-yl]-2-N-ethyl-1,2,3,4-tetrahydronaphthalene-1,2-diamine has a molecular weight of 275.44 g/mol, XLogP of 2.27, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-[1-(dimethylamino)propan-2-yl]-2-N-ethyl-1,2,3,4-tetrahydronaphthalene-1,2-diamine is sourced from PubChem (CID 103188495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).