2-chloro-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine

C6H15ClN2 — CID 157189725

IUPAC2-chloro-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine
SMILESCN(C)C(CCl)N(C)C
InChIInChI=1S/C6H15ClN2/c1-8(2)6(5-7)9(3)4/h6H,5H2,1-4H3
InChIKeyAPOCOGMKPSTHOP-UHFFFAOYSA-N
MW150.65 g/mol
LogP0.67
Rot. Bonds3

About 2-chloro-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine

2-chloro-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine (PubChem CID 157189725) has the molecular formula C6H15ClN2 and a molecular weight of 150.65 g/mol. Its IUPAC name is 2-chloro-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine.

Molecular Properties

Compound Name2-chloro-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine
PubChem CID157189725
Molecular FormulaC6H15ClN2
Molecular Weight150.65 g/mol
Exact Mass150.09
IUPAC Name2-chloro-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine
SMILESCN(C)C(CCl)N(C)C
InChIInChI=1S/C6H15ClN2/c1-8(2)6(5-7)9(3)4/h6H,5H2,1-4H3
InChIKeyAPOCOGMKPSTHOP-UHFFFAOYSA-N
XLogP0.67
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.65
LogP ≤ 50.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze 2-chloro-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-N,1-N,1-N',1-N',3-N,3-N,3-N',3-N'-octamethylpropane-1,1,3,3-tetramine
CID 87407012
1,2-dichloro-N,N-dimethylethanamine;hydrate
CID 90102639
2,2-bis(dimethylamino)ethanol
CID 57031094
1-N,1-N,1-N',1-N',7-N,7-N,7-N',7-N'-octamethylheptane-1,1,7,7-tetramine
CID 87407366
(1S)-2-chloro-N,N-dimethyl-1-methylsulfanylethanamine
CID 55302478
1-chloro-N-ethyl-N-methylbutan-2-amine
CID 130629325
1-N,1-N,1-N',1-N',3-N,3-N-hexamethylpropane-1,1,3-triamine
CID 87406982
1-N,1-N,1-N',1-N'-tetramethyl-2-N-silylethane-1,1,2-triamine
CID 123544836
1-N',1-N'-diiodo-1-N,1-N-dimethylpropane-1,1-diamine
CID 175405090
6-chloro-N,N,5-trimethylhexan-3-amine
CID 88740860
2-[2-[2-[2,2-bis(dimethylamino)ethoxy]ethoxy]ethoxy]-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine
CID 141061045
1-N,1-N,1-N',1-N',3-pentamethylpentane-1,1-diamine
CID 23505022

Frequently Asked Questions

What is the IUPAC name of 2-chloro-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine?
The IUPAC name of 2-chloro-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine (CID 157189725) is 2-chloro-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine.
What is the SMILES notation for 2-chloro-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine?
The canonical SMILES for 2-chloro-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine is CN(C)C(CCl)N(C)C.
What is the InChIKey of 2-chloro-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine?
The InChIKey is APOCOGMKPSTHOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15ClN2/c1-8(2)6(5-7)9(3)4/h6H,5H2,1-4H3.
What are the key properties of 2-chloro-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine?
2-chloro-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine has a molecular weight of 150.65 g/mol, XLogP of 0.67, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine is sourced from PubChem (CID 157189725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).