N'-(5,6,7,8-tetrahydronaphthalen-2-yl)ethane-1,2-diamine

C12H18N2 — CID 82490968

IUPACN'-(5,6,7,8-tetrahydronaphthalen-2-yl)ethane-1,2-diamine
SMILESNCCNc1ccc2c(c1)CCCC2
InChIInChI=1S/C12H18N2/c13-7-8-14-12-6-5-10-3-1-2-4-11(10)9-12/h5-6,9,14H,1-4,7-8,13H2
InChIKeySYTXTGLSUOWXCV-UHFFFAOYSA-N
MW190.29 g/mol
LogP1.94
Rot. Bonds3

About N'-(5,6,7,8-tetrahydronaphthalen-2-yl)ethane-1,2-diamine

N'-(5,6,7,8-tetrahydronaphthalen-2-yl)ethane-1,2-diamine (PubChem CID 82490968) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is N'-(5,6,7,8-tetrahydronaphthalen-2-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-(5,6,7,8-tetrahydronaphthalen-2-yl)ethane-1,2-diamine
PubChem CID82490968
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC NameN'-(5,6,7,8-tetrahydronaphthalen-2-yl)ethane-1,2-diamine
SMILESNCCNc1ccc2c(c1)CCCC2
InChIInChI=1S/C12H18N2/c13-7-8-14-12-6-5-10-3-1-2-4-11(10)9-12/h5-6,9,14H,1-4,7-8,13H2
InChIKeySYTXTGLSUOWXCV-UHFFFAOYSA-N
XLogP1.94
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 ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N'-(2,3-dihydro-1H-inden-5-yl)pentane-1,5-diamine
CID 59229873
N-methyl-N'-(5,6,7,8-tetrahydronaphthalen-2-yl)propane-1,3-diamine
CID 115197636
N-(bromomethyl)-5,6,7,8-tetrahydronaphthalen-2-amine
CID 115261521
2-methyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)butane-1,4-diamine
CID 115202278
N-(3,3,3-trifluoropropyl)-2,3-dihydro-1H-inden-5-amine
CID 64554180
2-methyl-N'-(5,6,7,8-tetrahydronaphthalen-2-yl)propane-1,3-diamine
CID 115198218
N'-(2,3-dihydro-1H-inden-5-yl)-N-ethylethane-1,2-diamine
CID 115205551
1-N-(2,3-dihydro-1H-inden-5-yl)-4-methylpentane-1,4-diamine
CID 115205117
N-(4,4-dimethylpentyl)-2,3-dihydro-1H-inden-5-amine
CID 114209369
N'-(2,3-dihydro-1H-inden-5-yl)-N-methylmethanediamine
CID 115226489
4-[(2,3-dihydro-1H-inden-5-ylamino)methyl]-2-fluorophenol
CID 107685267
N-[[4-(methylamino)phenyl]methyl]-5,6,7,8-tetrahydronaphthalen-2-amine
CID 115212622

Frequently Asked Questions

What is the IUPAC name of N'-(5,6,7,8-tetrahydronaphthalen-2-yl)ethane-1,2-diamine?
The IUPAC name of N'-(5,6,7,8-tetrahydronaphthalen-2-yl)ethane-1,2-diamine (CID 82490968) is N'-(5,6,7,8-tetrahydronaphthalen-2-yl)ethane-1,2-diamine.
What is the SMILES notation for N'-(5,6,7,8-tetrahydronaphthalen-2-yl)ethane-1,2-diamine?
The canonical SMILES for N'-(5,6,7,8-tetrahydronaphthalen-2-yl)ethane-1,2-diamine is NCCNc1ccc2c(c1)CCCC2.
What is the InChIKey of N'-(5,6,7,8-tetrahydronaphthalen-2-yl)ethane-1,2-diamine?
The InChIKey is SYTXTGLSUOWXCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c13-7-8-14-12-6-5-10-3-1-2-4-11(10)9-12/h5-6,9,14H,1-4,7-8,13H2.
What are the key properties of N'-(5,6,7,8-tetrahydronaphthalen-2-yl)ethane-1,2-diamine?
N'-(5,6,7,8-tetrahydronaphthalen-2-yl)ethane-1,2-diamine has a molecular weight of 190.29 g/mol, XLogP of 1.94, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(5,6,7,8-tetrahydronaphthalen-2-yl)ethane-1,2-diamine is sourced from PubChem (CID 82490968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).