(2,5-dichlorophenyl)methanamine;hydrochloride

C7H8Cl3N — CID 11356322

IUPAC(2,5-dichlorophenyl)methanamine;hydrochloride
SMILESCl.NCc1cc(Cl)ccc1Cl
InChIInChI=1S/C7H7Cl2N.ClH/c8-6-1-2-7(9)5(3-6)4-10;/h1-3H,4,10H2;1H
InChIKeyHVNKYAIWUNGQDU-UHFFFAOYSA-N
MW212.51 g/mol
LogP2.87
Rot. Bonds1

About (2,5-dichlorophenyl)methanamine;hydrochloride

(2,5-dichlorophenyl)methanamine;hydrochloride (PubChem CID 11356322) has the molecular formula C7H8Cl3N and a molecular weight of 212.51 g/mol. Its IUPAC name is (2,5-dichlorophenyl)methanamine;hydrochloride.

Molecular Properties

Compound Name(2,5-dichlorophenyl)methanamine;hydrochloride
PubChem CID11356322
Molecular FormulaC7H8Cl3N
Molecular Weight212.51 g/mol
Exact Mass210.97
IUPAC Name(2,5-dichlorophenyl)methanamine;hydrochloride
SMILESCl.NCc1cc(Cl)ccc1Cl
InChIInChI=1S/C7H7Cl2N.ClH/c8-6-1-2-7(9)5(3-6)4-10;/h1-3H,4,10H2;1H
InChIKeyHVNKYAIWUNGQDU-UHFFFAOYSA-N
XLogP2.87
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.51
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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azane;1,4-dichloro-2-(chloromethyl)benzene
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(2,5-dichlorophenyl)methanethiol
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[5-chloro-2-(4-chloronaphthalen-1-yl)phenyl]methanamine
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2-[(2,5-dichlorophenyl)methyl]-3-methylbutan-1-amine
CID 65318187
[5-bromo-2-[(2,5-dichlorophenyl)methoxy]phenyl]methanamine
CID 65318162
4-[(2,5-dichlorophenyl)methyl]aniline
CID 21272493
[2-[2-(aminomethyl)-4-chlorophenyl]phenyl]methanamine
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Frequently Asked Questions

What is the IUPAC name of (2,5-dichlorophenyl)methanamine;hydrochloride?
The IUPAC name of (2,5-dichlorophenyl)methanamine;hydrochloride (CID 11356322) is (2,5-dichlorophenyl)methanamine;hydrochloride.
What is the SMILES notation for (2,5-dichlorophenyl)methanamine;hydrochloride?
The canonical SMILES for (2,5-dichlorophenyl)methanamine;hydrochloride is Cl.NCc1cc(Cl)ccc1Cl.
What is the InChIKey of (2,5-dichlorophenyl)methanamine;hydrochloride?
The InChIKey is HVNKYAIWUNGQDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7Cl2N.ClH/c8-6-1-2-7(9)5(3-6)4-10;/h1-3H,4,10H2;1H.
What are the key properties of (2,5-dichlorophenyl)methanamine;hydrochloride?
(2,5-dichlorophenyl)methanamine;hydrochloride has a molecular weight of 212.51 g/mol, XLogP of 2.87, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dichlorophenyl)methanamine;hydrochloride is sourced from PubChem (CID 11356322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).