(3,5-dichlorophenyl)-(5-methyl-3-pyridinyl)methanamine

C13H12Cl2N2 — CID 105023142

IUPAC(3,5-dichlorophenyl)-(5-methyl-3-pyridinyl)methanamine
SMILESCc1cncc(C(N)c2cc(Cl)cc(Cl)c2)c1
InChIInChI=1S/C13H12Cl2N2/c1-8-2-10(7-17-6-8)13(16)9-3-11(14)5-12(15)4-9/h2-7,13H,16H2,1H3
InChIKeyDRWSGBHIHQIDSM-UHFFFAOYSA-N
MW267.16 g/mol
LogP3.74
Rot. Bonds2

About (3,5-dichlorophenyl)-(5-methyl-3-pyridinyl)methanamine

(3,5-dichlorophenyl)-(5-methyl-3-pyridinyl)methanamine (PubChem CID 105023142) has the molecular formula C13H12Cl2N2 and a molecular weight of 267.16 g/mol. Its IUPAC name is (3,5-dichlorophenyl)-(5-methyl-3-pyridinyl)methanamine.

Molecular Properties

Compound Name(3,5-dichlorophenyl)-(5-methyl-3-pyridinyl)methanamine
PubChem CID105023142
Molecular FormulaC13H12Cl2N2
Molecular Weight267.16 g/mol
Exact Mass266.04
IUPAC Name(3,5-dichlorophenyl)-(5-methyl-3-pyridinyl)methanamine
SMILESCc1cncc(C(N)c2cc(Cl)cc(Cl)c2)c1
InChIInChI=1S/C13H12Cl2N2/c1-8-2-10(7-17-6-8)13(16)9-3-11(14)5-12(15)4-9/h2-7,13H,16H2,1H3
InChIKeyDRWSGBHIHQIDSM-UHFFFAOYSA-N
XLogP3.74
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.16
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (3,5-dichlorophenyl)-(5-methyl-3-pyridinyl)methanamine 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

(4-fluorophenyl)-(5-methyl-3-pyridinyl)methanamine
CID 115374243
1-(3-chloro-5-methylphenyl)-N-methyl-1-(5-methyl-3-pyridinyl)methanamine
CID 105023291
(5-bromothiophen-3-yl)-(5-methyl-3-pyridinyl)methanamine
CID 105173903
furan-3-yl-(5-methyl-3-pyridinyl)methanamine
CID 115374562
(3,5-dichlorophenyl)-(6-methyl-3-pyridinyl)methanamine
CID 115854907
[(3-bromo-5-chlorophenyl)-(5-methyl-3-pyridinyl)methyl]hydrazine
CID 107948433
(2-chloro-3-fluorophenyl)-(5-methyl-3-pyridinyl)methanamine
CID 105023063
3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(5-methyl-3-pyridinyl)methanamine
CID 105143380
(6-bromonaphthalen-2-yl)-(5-methyl-3-pyridinyl)methanamine
CID 105023264
(4-methoxy-3-methylphenyl)-(5-methyl-3-pyridinyl)methanamine
CID 113297303
(3-chloro-5-methylphenyl)-(4-fluoro-3,5-dimethylphenyl)methanamine
CID 81323717
(5-methyl-3-pyridinyl)-[3-(trifluoromethyl)phenyl]methanamine
CID 115374254

Frequently Asked Questions

What is the IUPAC name of (3,5-dichlorophenyl)-(5-methyl-3-pyridinyl)methanamine?
The IUPAC name of (3,5-dichlorophenyl)-(5-methyl-3-pyridinyl)methanamine (CID 105023142) is (3,5-dichlorophenyl)-(5-methyl-3-pyridinyl)methanamine.
What is the SMILES notation for (3,5-dichlorophenyl)-(5-methyl-3-pyridinyl)methanamine?
The canonical SMILES for (3,5-dichlorophenyl)-(5-methyl-3-pyridinyl)methanamine is Cc1cncc(C(N)c2cc(Cl)cc(Cl)c2)c1.
What is the InChIKey of (3,5-dichlorophenyl)-(5-methyl-3-pyridinyl)methanamine?
The InChIKey is DRWSGBHIHQIDSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12Cl2N2/c1-8-2-10(7-17-6-8)13(16)9-3-11(14)5-12(15)4-9/h2-7,13H,16H2,1H3.
What are the key properties of (3,5-dichlorophenyl)-(5-methyl-3-pyridinyl)methanamine?
(3,5-dichlorophenyl)-(5-methyl-3-pyridinyl)methanamine has a molecular weight of 267.16 g/mol, XLogP of 3.74, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dichlorophenyl)-(5-methyl-3-pyridinyl)methanamine is sourced from PubChem (CID 105023142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).