2-N-(3-chloro-2-pyridinyl)-2-N-methylpropane-1,2-diamine

C9H14ClN3 — CID 104556751

IUPAC2-N-(3-chloro-2-pyridinyl)-2-N-methylpropane-1,2-diamine
SMILESCC(CN)N(C)c1ncccc1Cl
InChIInChI=1S/C9H14ClN3/c1-7(6-11)13(2)9-8(10)4-3-5-12-9/h3-5,7H,6,11H2,1-2H3
InChIKeyCCXFWFWUIUUZHZ-UHFFFAOYSA-N
MW199.69 g/mol
LogP1.52
Rot. Bonds3

About 2-N-(3-chloro-2-pyridinyl)-2-N-methylpropane-1,2-diamine

2-N-(3-chloro-2-pyridinyl)-2-N-methylpropane-1,2-diamine (PubChem CID 104556751) has the molecular formula C9H14ClN3 and a molecular weight of 199.69 g/mol. Its IUPAC name is 2-N-(3-chloro-2-pyridinyl)-2-N-methylpropane-1,2-diamine.

Molecular Properties

Compound Name2-N-(3-chloro-2-pyridinyl)-2-N-methylpropane-1,2-diamine
PubChem CID104556751
Molecular FormulaC9H14ClN3
Molecular Weight199.69 g/mol
Exact Mass199.09
IUPAC Name2-N-(3-chloro-2-pyridinyl)-2-N-methylpropane-1,2-diamine
SMILESCC(CN)N(C)c1ncccc1Cl
InChIInChI=1S/C9H14ClN3/c1-7(6-11)13(2)9-8(10)4-3-5-12-9/h3-5,7H,6,11H2,1-2H3
InChIKeyCCXFWFWUIUUZHZ-UHFFFAOYSA-N
XLogP1.52
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.69
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Launch Full Analysis

Related Compounds

2-N-(3-fluoro-2-pyridinyl)-2-N-methylpropane-1,2-diamine
CID 83828629
3-[(3-chloro-2-pyridinyl)-methylamino]butanimidamide
CID 63224568
N-but-3-yn-2-yl-3-chloro-N-methylpyridin-2-amine
CID 130652124
N'-(3-chloro-2-pyridinyl)-N'-methylpropane-1,3-diamine
CID 60870040
3-(aminomethyl)-N-[1-(2-chlorophenyl)ethyl]-N-methylpyridin-2-amine
CID 62980697
4-[(3-chloro-2-pyridinyl)-methylamino]butan-2-ol
CID 115689322
2-[(3-amino-2-pyridinyl)-methylamino]propan-1-ol
CID 104551058
2-N-methyl-2-N-([1,3]oxazolo[5,4-b]pyridin-2-yl)propane-1,2-diamine
CID 83833362
2-[(3-chloro-2-pyridinyl)-methylamino]ethanol
CID 10241546
N,N-dibutyl-3-chloropyridin-2-amine
CID 135025261
3-[1-aminopropan-2-yl(methyl)amino]-1H-pyrazin-2-one
CID 114571498
N-(2-bromoethyl)-3-chloro-N-propan-2-ylpyridin-2-amine
CID 80670684

Frequently Asked Questions

What is the IUPAC name of 2-N-(3-chloro-2-pyridinyl)-2-N-methylpropane-1,2-diamine?
The IUPAC name of 2-N-(3-chloro-2-pyridinyl)-2-N-methylpropane-1,2-diamine (CID 104556751) is 2-N-(3-chloro-2-pyridinyl)-2-N-methylpropane-1,2-diamine.
What is the SMILES notation for 2-N-(3-chloro-2-pyridinyl)-2-N-methylpropane-1,2-diamine?
The canonical SMILES for 2-N-(3-chloro-2-pyridinyl)-2-N-methylpropane-1,2-diamine is CC(CN)N(C)c1ncccc1Cl.
What is the InChIKey of 2-N-(3-chloro-2-pyridinyl)-2-N-methylpropane-1,2-diamine?
The InChIKey is CCXFWFWUIUUZHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14ClN3/c1-7(6-11)13(2)9-8(10)4-3-5-12-9/h3-5,7H,6,11H2,1-2H3.
What are the key properties of 2-N-(3-chloro-2-pyridinyl)-2-N-methylpropane-1,2-diamine?
2-N-(3-chloro-2-pyridinyl)-2-N-methylpropane-1,2-diamine has a molecular weight of 199.69 g/mol, XLogP of 1.52, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(3-chloro-2-pyridinyl)-2-N-methylpropane-1,2-diamine is sourced from PubChem (CID 104556751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).