2-N-(2-methylpropyl)-2-N-propan-2-yl-1,2,3,4-tetrahydronaphthalene-1,2-diamine

C17H28N2 — CID 54999713

IUPAC2-N-(2-methylpropyl)-2-N-propan-2-yl-1,2,3,4-tetrahydronaphthalene-1,2-diamine
SMILESCC(C)CN(C(C)C)C1CCc2ccccc2C1N
InChIInChI=1S/C17H28N2/c1-12(2)11-19(13(3)4)16-10-9-14-7-5-6-8-15(14)17(16)18/h5-8,12-13,16-17H,9-11,18H2,1-4H3
InChIKeyTXSZXCWBTCQZOZ-UHFFFAOYSA-N
MW260.43 g/mol
LogP3.37
Rot. Bonds4

About 2-N-(2-methylpropyl)-2-N-propan-2-yl-1,2,3,4-tetrahydronaphthalene-1,2-diamine

2-N-(2-methylpropyl)-2-N-propan-2-yl-1,2,3,4-tetrahydronaphthalene-1,2-diamine (PubChem CID 54999713) has the molecular formula C17H28N2 and a molecular weight of 260.43 g/mol. Its IUPAC name is 2-N-(2-methylpropyl)-2-N-propan-2-yl-1,2,3,4-tetrahydronaphthalene-1,2-diamine.

Molecular Properties

Compound Name2-N-(2-methylpropyl)-2-N-propan-2-yl-1,2,3,4-tetrahydronaphthalene-1,2-diamine
PubChem CID54999713
Molecular FormulaC17H28N2
Molecular Weight260.43 g/mol
Exact Mass260.23
IUPAC Name2-N-(2-methylpropyl)-2-N-propan-2-yl-1,2,3,4-tetrahydronaphthalene-1,2-diamine
SMILESCC(C)CN(C(C)C)C1CCc2ccccc2C1N
InChIInChI=1S/C17H28N2/c1-12(2)11-19(13(3)4)16-10-9-14-7-5-6-8-15(14)17(16)18/h5-8,12-13,16-17H,9-11,18H2,1-4H3
InChIKeyTXSZXCWBTCQZOZ-UHFFFAOYSA-N
XLogP3.37
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.43
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-N-[1-(dimethylamino)propan-2-yl]-2-N-ethyl-1,2,3,4-tetrahydronaphthalene-1,2-diamine
CID 103188495
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
N-(2-methylpropyl)-N-propan-2-yl-1,2,3,4-tetrahydroisoquinolin-4-amine
CID 63939368
2-N-ethyl-2-N-(2-methoxyethyl)-1,2,3,4-tetrahydronaphthalene-1,2-diamine
CID 61447898
6-methoxy-2-N-propan-2-yl-2-N-propyl-1,2,3,4-tetrahydronaphthalene-1,2-diamine
CID 43269499
2-N-(2-methoxyethyl)-2-N-(2-methylpropyl)-2,3-dihydro-1H-indene-1,2-diamine
CID 54986887
2-N-(2-methoxyethyl)-1-N-methyl-2-N-propan-2-yl-1,2,3,4-tetrahydronaphthalene-1,2-diamine
CID 82948042
2-N-ethyl-7-methoxy-2-N-(2-methylpropyl)-1,2,3,4-tetrahydronaphthalene-1,2-diamine
CID 79248139
6-(2-propan-2-yloxyethoxy)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 43183746

Frequently Asked Questions

What is the IUPAC name of 2-N-(2-methylpropyl)-2-N-propan-2-yl-1,2,3,4-tetrahydronaphthalene-1,2-diamine?
The IUPAC name of 2-N-(2-methylpropyl)-2-N-propan-2-yl-1,2,3,4-tetrahydronaphthalene-1,2-diamine (CID 54999713) is 2-N-(2-methylpropyl)-2-N-propan-2-yl-1,2,3,4-tetrahydronaphthalene-1,2-diamine.
What is the SMILES notation for 2-N-(2-methylpropyl)-2-N-propan-2-yl-1,2,3,4-tetrahydronaphthalene-1,2-diamine?
The canonical SMILES for 2-N-(2-methylpropyl)-2-N-propan-2-yl-1,2,3,4-tetrahydronaphthalene-1,2-diamine is CC(C)CN(C(C)C)C1CCc2ccccc2C1N.
What is the InChIKey of 2-N-(2-methylpropyl)-2-N-propan-2-yl-1,2,3,4-tetrahydronaphthalene-1,2-diamine?
The InChIKey is TXSZXCWBTCQZOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2/c1-12(2)11-19(13(3)4)16-10-9-14-7-5-6-8-15(14)17(16)18/h5-8,12-13,16-17H,9-11,18H2,1-4H3.
What are the key properties of 2-N-(2-methylpropyl)-2-N-propan-2-yl-1,2,3,4-tetrahydronaphthalene-1,2-diamine?
2-N-(2-methylpropyl)-2-N-propan-2-yl-1,2,3,4-tetrahydronaphthalene-1,2-diamine has a molecular weight of 260.43 g/mol, XLogP of 3.37, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(2-methylpropyl)-2-N-propan-2-yl-1,2,3,4-tetrahydronaphthalene-1,2-diamine is sourced from PubChem (CID 54999713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).