5,6,7,8-tetrahydronaphthalene-1,6-diamine

C10H14N2 — CID 14836578

IUPAC5,6,7,8-tetrahydronaphthalene-1,6-diamine
SMILESNc1cccc2c1CCC(N)C2
InChIInChI=1S/C10H14N2/c11-8-4-5-9-7(6-8)2-1-3-10(9)12/h1-3,8H,4-6,11-12H2
InChIKeyCNOAMLYPWDTDOO-UHFFFAOYSA-N
MW162.24 g/mol
LogP1.08
Rot. Bonds

About 5,6,7,8-tetrahydronaphthalene-1,6-diamine

5,6,7,8-tetrahydronaphthalene-1,6-diamine (PubChem CID 14836578) has the molecular formula C10H14N2 and a molecular weight of 162.24 g/mol. Its IUPAC name is 5,6,7,8-tetrahydronaphthalene-1,6-diamine.

Molecular Properties

Compound Name5,6,7,8-tetrahydronaphthalene-1,6-diamine
PubChem CID14836578
Molecular FormulaC10H14N2
Molecular Weight162.24 g/mol
Exact Mass162.12
IUPAC Name5,6,7,8-tetrahydronaphthalene-1,6-diamine
SMILESNc1cccc2c1CCC(N)C2
InChIInChI=1S/C10H14N2/c11-8-4-5-9-7(6-8)2-1-3-10(9)12/h1-3,8H,4-6,11-12H2
InChIKeyCNOAMLYPWDTDOO-UHFFFAOYSA-N
XLogP1.08
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.24
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

6-(aminomethyl)-5,6,7,8-tetrahydronaphthalen-1-amine
CID 105436645
(6R)-6-amino-5,6,7,8-tetrahydronaphthalene-1-carbonitrile
CID 55294355
(2R)-5-chloro-1,2,3,4-tetrahydronaphthalene-2,6-diamine
CID 130898043
5-amino-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid
CID 105444904
benzene;1,2,3,4-tetrahydronaphthalen-2-amine
CID 66647094
1,2,3,4-tetrahydronaphthalen-2-amine;trihydrochloride
CID 67686398
N-[(6R)-6-amino-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide;hydrochloride
CID 18650731
6-N-methyl-6-N-propyl-5,6,7,8-tetrahydronaphthalene-1,6-diamine;dihydrochloride
CID 19773414
(6R)-6-N,6-N-dipropyl-5,6,7,8-tetrahydronaphthalene-1,6-diamine;dihydrochloride
CID 18650733
2,3-dihydro-1H-indene-1,4-diamine
CID 55293440
(2S)-8-iodo-1,2,3,4-tetrahydronaphthalen-2-amine
CID 131030686
6-N-ethyl-6-N-propyl-5,6,7,8-tetrahydronaphthalene-1,6-diamine
CID 14836516

Frequently Asked Questions

What is the IUPAC name of 5,6,7,8-tetrahydronaphthalene-1,6-diamine?
The IUPAC name of 5,6,7,8-tetrahydronaphthalene-1,6-diamine (CID 14836578) is 5,6,7,8-tetrahydronaphthalene-1,6-diamine.
What is the SMILES notation for 5,6,7,8-tetrahydronaphthalene-1,6-diamine?
The canonical SMILES for 5,6,7,8-tetrahydronaphthalene-1,6-diamine is Nc1cccc2c1CCC(N)C2.
What is the InChIKey of 5,6,7,8-tetrahydronaphthalene-1,6-diamine?
The InChIKey is CNOAMLYPWDTDOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2/c11-8-4-5-9-7(6-8)2-1-3-10(9)12/h1-3,8H,4-6,11-12H2.
What are the key properties of 5,6,7,8-tetrahydronaphthalene-1,6-diamine?
5,6,7,8-tetrahydronaphthalene-1,6-diamine has a molecular weight of 162.24 g/mol, XLogP of 1.08, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6,7,8-tetrahydronaphthalene-1,6-diamine is sourced from PubChem (CID 14836578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).