2-(3,4-dichlorophenyl)-N-methyl-1-pyridin-2-ylethanamine

C14H14Cl2N2 — CID 62601667

IUPAC2-(3,4-dichlorophenyl)-N-methyl-1-pyridin-2-ylethanamine
SMILESCNC(Cc1ccc(Cl)c(Cl)c1)c1ccccn1
InChIInChI=1S/C14H14Cl2N2/c1-17-14(13-4-2-3-7-18-13)9-10-5-6-11(15)12(16)8-10/h2-8,14,17H,9H2,1H3
InChIKeyIWFWKVHWPNLPNP-UHFFFAOYSA-N
MW281.19 g/mol
LogP3.89
Rot. Bonds4

About 2-(3,4-dichlorophenyl)-N-methyl-1-pyridin-2-ylethanamine

2-(3,4-dichlorophenyl)-N-methyl-1-pyridin-2-ylethanamine (PubChem CID 62601667) has the molecular formula C14H14Cl2N2 and a molecular weight of 281.19 g/mol. Its IUPAC name is 2-(3,4-dichlorophenyl)-N-methyl-1-pyridin-2-ylethanamine.

Molecular Properties

Compound Name2-(3,4-dichlorophenyl)-N-methyl-1-pyridin-2-ylethanamine
PubChem CID62601667
Molecular FormulaC14H14Cl2N2
Molecular Weight281.19 g/mol
Exact Mass280.05
IUPAC Name2-(3,4-dichlorophenyl)-N-methyl-1-pyridin-2-ylethanamine
SMILESCNC(Cc1ccc(Cl)c(Cl)c1)c1ccccn1
InChIInChI=1S/C14H14Cl2N2/c1-17-14(13-4-2-3-7-18-13)9-10-5-6-11(15)12(16)8-10/h2-8,14,17H,9H2,1H3
InChIKeyIWFWKVHWPNLPNP-UHFFFAOYSA-N
XLogP3.89
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.19
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-chlorophenyl)-2-(3,4-dichlorophenyl)-N-methylethanamine
CID 63415410
N-[(3,4-dichlorophenyl)methyl]-1-pyridin-2-ylethanamine
CID 43181276
(1S)-N-[(3,4-dichlorophenyl)methyl]-1-pyridin-2-ylethanamine
CID 28647738
N-methyl-1-pyridin-2-yl-2-[3-(trifluoromethyl)phenyl]ethanamine
CID 62600521
2-(3,4-dichlorophenyl)-N-(1-pyridin-2-ylethyl)acetamide
CID 47097455
N-[2-(3,4-dichlorophenyl)-1-(2-methyl-3-pyridinyl)ethyl]propan-1-amine
CID 105136518
2-(3,4-dichlorophenyl)-N-ethyl-1-(3-ethyl-2-pyridinyl)ethanamine
CID 82732781
1-(3,4-dichlorophenyl)-N-ethyl-4-pyridin-2-ylbutan-2-amine
CID 105136549
N-[2-(3,4-dichlorophenyl)-1-phenylethyl]propan-1-amine
CID 63413061
2-(2,6-dichlorophenyl)-N-ethyl-1-pyridin-2-ylethanamine
CID 62602818
N'-ethyl-N-methyl-1-pyridin-2-ylethane-1,2-diamine
CID 116950392
2-(4-chlorophenyl)-1-(3,4-dichlorophenyl)-N-methylethanamine
CID 43486451

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dichlorophenyl)-N-methyl-1-pyridin-2-ylethanamine?
The IUPAC name of 2-(3,4-dichlorophenyl)-N-methyl-1-pyridin-2-ylethanamine (CID 62601667) is 2-(3,4-dichlorophenyl)-N-methyl-1-pyridin-2-ylethanamine.
What is the SMILES notation for 2-(3,4-dichlorophenyl)-N-methyl-1-pyridin-2-ylethanamine?
The canonical SMILES for 2-(3,4-dichlorophenyl)-N-methyl-1-pyridin-2-ylethanamine is CNC(Cc1ccc(Cl)c(Cl)c1)c1ccccn1.
What is the InChIKey of 2-(3,4-dichlorophenyl)-N-methyl-1-pyridin-2-ylethanamine?
The InChIKey is IWFWKVHWPNLPNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14Cl2N2/c1-17-14(13-4-2-3-7-18-13)9-10-5-6-11(15)12(16)8-10/h2-8,14,17H,9H2,1H3.
What are the key properties of 2-(3,4-dichlorophenyl)-N-methyl-1-pyridin-2-ylethanamine?
2-(3,4-dichlorophenyl)-N-methyl-1-pyridin-2-ylethanamine has a molecular weight of 281.19 g/mol, XLogP of 3.89, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dichlorophenyl)-N-methyl-1-pyridin-2-ylethanamine is sourced from PubChem (CID 62601667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).