N'-(5-chloro-2-pyridinyl)ethane-1,2-diamine;hydrochloride

C7H11Cl2N3 — CID 18507461

IUPACN'-(5-chloro-2-pyridinyl)ethane-1,2-diamine;hydrochloride
SMILESCl.NCCNc1ccc(Cl)cn1
InChIInChI=1S/C7H10ClN3.ClH/c8-6-1-2-7(11-5-6)10-4-3-9;/h1-2,5H,3-4,9H2,(H,10,11);1H
InChIKeyYJADRDMVWVZYEW-UHFFFAOYSA-N
MW208.09 g/mol
LogP1.53
Rot. Bonds3

About N'-(5-chloro-2-pyridinyl)ethane-1,2-diamine;hydrochloride

N'-(5-chloro-2-pyridinyl)ethane-1,2-diamine;hydrochloride (PubChem CID 18507461) has the molecular formula C7H11Cl2N3 and a molecular weight of 208.09 g/mol. Its IUPAC name is N'-(5-chloro-2-pyridinyl)ethane-1,2-diamine;hydrochloride.

Molecular Properties

Compound NameN'-(5-chloro-2-pyridinyl)ethane-1,2-diamine;hydrochloride
PubChem CID18507461
Molecular FormulaC7H11Cl2N3
Molecular Weight208.09 g/mol
Exact Mass207.03
IUPAC NameN'-(5-chloro-2-pyridinyl)ethane-1,2-diamine;hydrochloride
SMILESCl.NCCNc1ccc(Cl)cn1
InChIInChI=1S/C7H10ClN3.ClH/c8-6-1-2-7(11-5-6)10-4-3-9;/h1-2,5H,3-4,9H2,(H,10,11);1H
InChIKeyYJADRDMVWVZYEW-UHFFFAOYSA-N
XLogP1.53
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.09
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N'-(5-chloro-2-pyridinyl)pentane-1,5-diamine
CID 107323387
3-[(5-chloro-2-pyridinyl)amino]propan-1-ol
CID 29043106
N'-(5-chloro-2-pyridinyl)-2,2-dimethylpropane-1,3-diamine
CID 115366147
5-chloro-N-(3-chlorobutyl)pyridin-2-amine
CID 65028422
N'-(5-isocyano-2-pyridinyl)ethane-1,2-diamine
CID 59106726
N-[[4-(2-aminoethyl)phenyl]methyl]-5-chloropyridin-2-amine
CID 62503194
6-(2-aminoethylamino)pyridine-3-carbonitrile
CID 11369405
N'-(5-nitro-2-pyridinyl)ethane-1,2-diamine;trihydrochloride
CID 141018206
4-[(5-chloro-2-pyridinyl)amino]butanoic acid
CID 24698899
N'-(5-nitro-2-pyridinyl)ethane-1,2-diamine;hydrochloride
CID 141044426
5-chloro-N-(3-phenylpropyl)pyridin-2-amine
CID 54931106
2-[(5-chloro-2-pyridinyl)amino]ethyl-diethylazanium chloride
CID 110175206

Frequently Asked Questions

What is the IUPAC name of N'-(5-chloro-2-pyridinyl)ethane-1,2-diamine;hydrochloride?
The IUPAC name of N'-(5-chloro-2-pyridinyl)ethane-1,2-diamine;hydrochloride (CID 18507461) is N'-(5-chloro-2-pyridinyl)ethane-1,2-diamine;hydrochloride.
What is the SMILES notation for N'-(5-chloro-2-pyridinyl)ethane-1,2-diamine;hydrochloride?
The canonical SMILES for N'-(5-chloro-2-pyridinyl)ethane-1,2-diamine;hydrochloride is Cl.NCCNc1ccc(Cl)cn1.
What is the InChIKey of N'-(5-chloro-2-pyridinyl)ethane-1,2-diamine;hydrochloride?
The InChIKey is YJADRDMVWVZYEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10ClN3.ClH/c8-6-1-2-7(11-5-6)10-4-3-9;/h1-2,5H,3-4,9H2,(H,10,11);1H.
What are the key properties of N'-(5-chloro-2-pyridinyl)ethane-1,2-diamine;hydrochloride?
N'-(5-chloro-2-pyridinyl)ethane-1,2-diamine;hydrochloride has a molecular weight of 208.09 g/mol, XLogP of 1.53, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(5-chloro-2-pyridinyl)ethane-1,2-diamine;hydrochloride is sourced from PubChem (CID 18507461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).