(2,4-dichlorophenyl)-(1-methylcyclopropyl)methanamine

C11H13Cl2N — CID 130517016

IUPAC(2,4-dichlorophenyl)-(1-methylcyclopropyl)methanamine
SMILESCC1(C(N)c2ccc(Cl)cc2Cl)CC1
InChIInChI=1S/C11H13Cl2N/c1-11(4-5-11)10(14)8-3-2-7(12)6-9(8)13/h2-3,6,10H,4-5,14H2,1H3
InChIKeyQJSJVDBQVYQKLT-UHFFFAOYSA-N
MW230.14 g/mol
LogP3.79
Rot. Bonds2

About (2,4-dichlorophenyl)-(1-methylcyclopropyl)methanamine

(2,4-dichlorophenyl)-(1-methylcyclopropyl)methanamine (PubChem CID 130517016) has the molecular formula C11H13Cl2N and a molecular weight of 230.14 g/mol. Its IUPAC name is (2,4-dichlorophenyl)-(1-methylcyclopropyl)methanamine.

Molecular Properties

Compound Name(2,4-dichlorophenyl)-(1-methylcyclopropyl)methanamine
PubChem CID130517016
Molecular FormulaC11H13Cl2N
Molecular Weight230.14 g/mol
Exact Mass229.04
IUPAC Name(2,4-dichlorophenyl)-(1-methylcyclopropyl)methanamine
SMILESCC1(C(N)c2ccc(Cl)cc2Cl)CC1
InChIInChI=1S/C11H13Cl2N/c1-11(4-5-11)10(14)8-3-2-7(12)6-9(8)13/h2-3,6,10H,4-5,14H2,1H3
InChIKeyQJSJVDBQVYQKLT-UHFFFAOYSA-N
XLogP3.79
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.14
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-[amino-(2,4-dichlorophenyl)methyl]cyclopropan-1-amine
CID 116947104
(2,4-dichlorophenyl)-[1-(methylaminomethyl)cyclopropyl]methanamine
CID 116943597
(1S)-1-(2,4-dichlorophenyl)ethanamine
CID 2496562
1-(2,4-dichlorophenyl)ethanamine;ethane
CID 142953133
[3-(aminomethyl)oxetan-3-yl]-(2,4-dichlorophenyl)methanamine
CID 116944995
[(2,5-dichlorophenyl)-(1-methylcyclopropyl)methyl]hydrazine
CID 105253423
(R)-cyclopropyl-(2,4-dichlorophenyl)methanamine;hydrochloride
CID 171212549
(2,4-dichlorophenyl)-(1-methylpyrazol-4-yl)methanamine
CID 43124207
(1S)-1-(2,4-dichlorophenyl)butan-1-amine;hydrochloride
CID 171232141
(1R)-1-(2,4-dichlorophenyl)propane-1,3-diamine;hydrochloride
CID 171212529
(2,5-dichlorophenyl)-(2-methyloxan-2-yl)methanamine
CID 80685344
1-(2,4-dichlorophenyl)-3-ethylpentan-1-amine
CID 105028050

Frequently Asked Questions

What is the IUPAC name of (2,4-dichlorophenyl)-(1-methylcyclopropyl)methanamine?
The IUPAC name of (2,4-dichlorophenyl)-(1-methylcyclopropyl)methanamine (CID 130517016) is (2,4-dichlorophenyl)-(1-methylcyclopropyl)methanamine.
What is the SMILES notation for (2,4-dichlorophenyl)-(1-methylcyclopropyl)methanamine?
The canonical SMILES for (2,4-dichlorophenyl)-(1-methylcyclopropyl)methanamine is CC1(C(N)c2ccc(Cl)cc2Cl)CC1.
What is the InChIKey of (2,4-dichlorophenyl)-(1-methylcyclopropyl)methanamine?
The InChIKey is QJSJVDBQVYQKLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13Cl2N/c1-11(4-5-11)10(14)8-3-2-7(12)6-9(8)13/h2-3,6,10H,4-5,14H2,1H3.
What are the key properties of (2,4-dichlorophenyl)-(1-methylcyclopropyl)methanamine?
(2,4-dichlorophenyl)-(1-methylcyclopropyl)methanamine has a molecular weight of 230.14 g/mol, XLogP of 3.79, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-dichlorophenyl)-(1-methylcyclopropyl)methanamine is sourced from PubChem (CID 130517016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).