2-(aminomethyl)-5,7-dichloro-3,4-dihydro-1H-naphthalen-2-amine

C11H14Cl2N2 — CID 10037492

IUPAC2-(aminomethyl)-5,7-dichloro-3,4-dihydro-1H-naphthalen-2-amine
SMILESNCC1(N)CCc2c(Cl)cc(Cl)cc2C1
InChIInChI=1S/C11H14Cl2N2/c12-8-3-7-5-11(15,6-14)2-1-9(7)10(13)4-8/h3-4H,1-2,5-6,14-15H2
InChIKeyWJKNHBHGNUVWRK-UHFFFAOYSA-N
MW245.15 g/mol
LogP2.14
Rot. Bonds1

About 2-(aminomethyl)-5,7-dichloro-3,4-dihydro-1H-naphthalen-2-amine

2-(aminomethyl)-5,7-dichloro-3,4-dihydro-1H-naphthalen-2-amine (PubChem CID 10037492) has the molecular formula C11H14Cl2N2 and a molecular weight of 245.15 g/mol. Its IUPAC name is 2-(aminomethyl)-5,7-dichloro-3,4-dihydro-1H-naphthalen-2-amine.

Molecular Properties

Compound Name2-(aminomethyl)-5,7-dichloro-3,4-dihydro-1H-naphthalen-2-amine
PubChem CID10037492
Molecular FormulaC11H14Cl2N2
Molecular Weight245.15 g/mol
Exact Mass244.05
IUPAC Name2-(aminomethyl)-5,7-dichloro-3,4-dihydro-1H-naphthalen-2-amine
SMILESNCC1(N)CCc2c(Cl)cc(Cl)cc2C1
InChIInChI=1S/C11H14Cl2N2/c12-8-3-7-5-11(15,6-14)2-1-9(7)10(13)4-8/h3-4H,1-2,5-6,14-15H2
InChIKeyWJKNHBHGNUVWRK-UHFFFAOYSA-N
XLogP2.14
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.15
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(aminomethyl)-6,7-dichloro-3,4-dihydro-1H-naphthalen-2-amine
CID 10421947
2-(aminomethyl)-6,7-dimethyl-3,4-dihydro-1H-naphthalen-2-amine
CID 10442923
2-(aminomethyl)-3,4-dihydro-1H-naphthalen-2-amine;dichloroplatinum
CID 19741694
2-(aminomethyl)-8-chloro-5-methoxy-3,4-dihydro-1H-naphthalen-2-amine
CID 10263702
5,7-dichloro-2-ethyl-3,4-dihydro-1H-isoquinoline
CID 58157202
2-(aminomethyl)-6-chloro-3,4-dihydro-1H-naphthalen-2-ol
CID 105465643
1-[(5-chloro-2,2-dimethyl-3H-1-benzofuran-7-yl)methyl]cyclopropan-1-amine
CID 117382918
(4bS,8aR)-4b-(2-aminoethyl)-1,3-dichloro-5,6,7,8,9,10-hexahydrophenanthren-8a-ol
CID 57278159
2-(5,7-dichloro-3,4-dihydro-1H-isoquinolin-2-yl)acetamide
CID 110457058
acetamide;5,7-dichloro-1,2,3,4-tetrahydroisoquinoline
CID 175094246
6,8-dichloro-1,2,3,4-tetrahydroisoquinoline;hydrochloride
CID 12595080
6-amino-6-(hydroxymethyl)-7,8-dihydro-5H-naphthalen-2-ol
CID 13177868

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-5,7-dichloro-3,4-dihydro-1H-naphthalen-2-amine?
The IUPAC name of 2-(aminomethyl)-5,7-dichloro-3,4-dihydro-1H-naphthalen-2-amine (CID 10037492) is 2-(aminomethyl)-5,7-dichloro-3,4-dihydro-1H-naphthalen-2-amine.
What is the SMILES notation for 2-(aminomethyl)-5,7-dichloro-3,4-dihydro-1H-naphthalen-2-amine?
The canonical SMILES for 2-(aminomethyl)-5,7-dichloro-3,4-dihydro-1H-naphthalen-2-amine is NCC1(N)CCc2c(Cl)cc(Cl)cc2C1.
What is the InChIKey of 2-(aminomethyl)-5,7-dichloro-3,4-dihydro-1H-naphthalen-2-amine?
The InChIKey is WJKNHBHGNUVWRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14Cl2N2/c12-8-3-7-5-11(15,6-14)2-1-9(7)10(13)4-8/h3-4H,1-2,5-6,14-15H2.
What are the key properties of 2-(aminomethyl)-5,7-dichloro-3,4-dihydro-1H-naphthalen-2-amine?
2-(aminomethyl)-5,7-dichloro-3,4-dihydro-1H-naphthalen-2-amine has a molecular weight of 245.15 g/mol, XLogP of 2.14, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-5,7-dichloro-3,4-dihydro-1H-naphthalen-2-amine is sourced from PubChem (CID 10037492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).