1-(2-chlorophenyl)-N-methyl-3-methyliminopropan-2-amine

C11H15ClN2 — CID 57464353

IUPAC1-(2-chlorophenyl)-N-methyl-3-methyliminopropan-2-amine
SMILESC/N=C/C(Cc1ccccc1Cl)NC
InChIInChI=1S/C11H15ClN2/c1-13-8-10(14-2)7-9-5-3-4-6-11(9)12/h3-6,8,10,14H,7H2,1-2H3/b13-8+
InChIKeyFCUJCMYAWDVQCG-MDWZMJQESA-N
MW210.71 g/mol
LogP2.17
Rot. Bonds4

About 1-(2-chlorophenyl)-N-methyl-3-methyliminopropan-2-amine

1-(2-chlorophenyl)-N-methyl-3-methyliminopropan-2-amine (PubChem CID 57464353) has the molecular formula C11H15ClN2 and a molecular weight of 210.71 g/mol. Its IUPAC name is 1-(2-chlorophenyl)-N-methyl-3-methyliminopropan-2-amine.

Molecular Properties

Compound Name1-(2-chlorophenyl)-N-methyl-3-methyliminopropan-2-amine
PubChem CID57464353
Molecular FormulaC11H15ClN2
Molecular Weight210.71 g/mol
Exact Mass210.09
IUPAC Name1-(2-chlorophenyl)-N-methyl-3-methyliminopropan-2-amine
SMILESC/N=C/C(Cc1ccccc1Cl)NC
InChIInChI=1S/C11H15ClN2/c1-13-8-10(14-2)7-9-5-3-4-6-11(9)12/h3-6,8,10,14H,7H2,1-2H3/b13-8+
InChIKeyFCUJCMYAWDVQCG-MDWZMJQESA-N
XLogP2.17
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.71
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

4-(2-chlorophenyl)-N,3-dimethylbutan-2-amine
CID 60995305
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CID 66467241
1-(2-chloro-3-fluorophenyl)-3-(2-chlorophenyl)-N-methylpropan-2-amine
CID 115983710
1-(2-chlorophenyl)-3-cyclobutyl-N-methylpropan-2-amine
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CID 123440272
2-(2-chlorophenyl)-1-(2-iodophenyl)-N-methylethanamine
CID 61079847
1-(4-chloro-3-fluorophenyl)-3-(2-chlorophenyl)-N-methylpropan-2-amine
CID 107884614
1-(2-chlorophenyl)-N-methyldodecan-2-amine
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1-(2-chlorophenyl)-N-methylundecan-2-amine
CID 63415015
1-(2-chlorophenyl)-N-ethylpropan-2-amine
CID 43677539
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CID 79723957

Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenyl)-N-methyl-3-methyliminopropan-2-amine?
The IUPAC name of 1-(2-chlorophenyl)-N-methyl-3-methyliminopropan-2-amine (CID 57464353) is 1-(2-chlorophenyl)-N-methyl-3-methyliminopropan-2-amine.
What is the SMILES notation for 1-(2-chlorophenyl)-N-methyl-3-methyliminopropan-2-amine?
The canonical SMILES for 1-(2-chlorophenyl)-N-methyl-3-methyliminopropan-2-amine is C/N=C/C(Cc1ccccc1Cl)NC.
What is the InChIKey of 1-(2-chlorophenyl)-N-methyl-3-methyliminopropan-2-amine?
The InChIKey is FCUJCMYAWDVQCG-MDWZMJQESA-N. The full InChI is InChI=1S/C11H15ClN2/c1-13-8-10(14-2)7-9-5-3-4-6-11(9)12/h3-6,8,10,14H,7H2,1-2H3/b13-8+.
What are the key properties of 1-(2-chlorophenyl)-N-methyl-3-methyliminopropan-2-amine?
1-(2-chlorophenyl)-N-methyl-3-methyliminopropan-2-amine has a molecular weight of 210.71 g/mol, XLogP of 2.17, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenyl)-N-methyl-3-methyliminopropan-2-amine is sourced from PubChem (CID 57464353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).