N'-(1,2,3,4-tetrahydronaphthalen-1-yl)ethane-1,2-diamine

C12H18N2 — CID 60888348

IUPACN'-(1,2,3,4-tetrahydronaphthalen-1-yl)ethane-1,2-diamine
SMILESNCCNC1CCCc2ccccc21
InChIInChI=1S/C12H18N2/c13-8-9-14-12-7-3-5-10-4-1-2-6-11(10)12/h1-2,4,6,12,14H,3,5,7-9,13H2
InChIKeyJSGSCGSLVWIIFI-UHFFFAOYSA-N
MW190.29 g/mol
LogP1.61
Rot. Bonds3

About N'-(1,2,3,4-tetrahydronaphthalen-1-yl)ethane-1,2-diamine

N'-(1,2,3,4-tetrahydronaphthalen-1-yl)ethane-1,2-diamine (PubChem CID 60888348) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is N'-(1,2,3,4-tetrahydronaphthalen-1-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-(1,2,3,4-tetrahydronaphthalen-1-yl)ethane-1,2-diamine
PubChem CID60888348
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC NameN'-(1,2,3,4-tetrahydronaphthalen-1-yl)ethane-1,2-diamine
SMILESNCCNC1CCCc2ccccc21
InChIInChI=1S/C12H18N2/c13-8-9-14-12-7-3-5-10-4-1-2-6-11(10)12/h1-2,4,6,12,14H,3,5,7-9,13H2
InChIKeyJSGSCGSLVWIIFI-UHFFFAOYSA-N
XLogP1.61
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(1,2,3,4-tetrahydronaphthalen-1-ylamino)propanoic acid
CID 43087276
6-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-ylamino)hexan-1-ol
CID 103922340
N-(4-phenylbutyl)-1,2,3,4-tetrahydronaphthalen-1-amine;dihydrochloride
CID 19773300
N'-hydroxy-4-(1,2,3,4-tetrahydronaphthalen-1-ylamino)butanimidamide
CID 77028408
2-methyl-3-(1,2,3,4-tetrahydronaphthalen-1-ylamino)propanoic acid
CID 43652090
N-[2-(1-methylpiperidin-4-yl)ethyl]-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115717469
N',N'-diethyl-N-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-yl)propane-1,3-diamine
CID 43095798
N-(3-ethenoxypropyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 43207352
N-(2-pyridin-2-ylethyl)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 43193645
N-(cyclopentylmethyl)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 43370921
N-(3-methyl-2-propan-2-ylbutyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 102904359
N-[[(2S)-pyrrolidin-2-yl]methyl]-1,2,3,4-tetrahydronaphthalen-1-amine
CID 143330144

Frequently Asked Questions

What is the IUPAC name of N'-(1,2,3,4-tetrahydronaphthalen-1-yl)ethane-1,2-diamine?
The IUPAC name of N'-(1,2,3,4-tetrahydronaphthalen-1-yl)ethane-1,2-diamine (CID 60888348) is N'-(1,2,3,4-tetrahydronaphthalen-1-yl)ethane-1,2-diamine.
What is the SMILES notation for N'-(1,2,3,4-tetrahydronaphthalen-1-yl)ethane-1,2-diamine?
The canonical SMILES for N'-(1,2,3,4-tetrahydronaphthalen-1-yl)ethane-1,2-diamine is NCCNC1CCCc2ccccc21.
What is the InChIKey of N'-(1,2,3,4-tetrahydronaphthalen-1-yl)ethane-1,2-diamine?
The InChIKey is JSGSCGSLVWIIFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c13-8-9-14-12-7-3-5-10-4-1-2-6-11(10)12/h1-2,4,6,12,14H,3,5,7-9,13H2.
What are the key properties of N'-(1,2,3,4-tetrahydronaphthalen-1-yl)ethane-1,2-diamine?
N'-(1,2,3,4-tetrahydronaphthalen-1-yl)ethane-1,2-diamine has a molecular weight of 190.29 g/mol, XLogP of 1.61, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(1,2,3,4-tetrahydronaphthalen-1-yl)ethane-1,2-diamine is sourced from PubChem (CID 60888348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).