[1-(4-chloro-2,6-difluorophenyl)cyclopropyl]methanamine

C10H10ClF2N — CID 117310224

IUPAC[1-(4-chloro-2,6-difluorophenyl)cyclopropyl]methanamine
SMILESNCC1(c2c(F)cc(Cl)cc2F)CC1
InChIInChI=1S/C10H10ClF2N/c11-6-3-7(12)9(8(13)4-6)10(5-14)1-2-10/h3-4H,1-2,5,14H2
InChIKeyOLIWKNIKKMSRFQ-UHFFFAOYSA-N
MW217.65 g/mol
LogP2.61
Rot. Bonds2

About [1-(4-chloro-2,6-difluorophenyl)cyclopropyl]methanamine

[1-(4-chloro-2,6-difluorophenyl)cyclopropyl]methanamine (PubChem CID 117310224) has the molecular formula C10H10ClF2N and a molecular weight of 217.65 g/mol. Its IUPAC name is [1-(4-chloro-2,6-difluorophenyl)cyclopropyl]methanamine.

Molecular Properties

Compound Name[1-(4-chloro-2,6-difluorophenyl)cyclopropyl]methanamine
PubChem CID117310224
Molecular FormulaC10H10ClF2N
Molecular Weight217.65 g/mol
Exact Mass217.05
IUPAC Name[1-(4-chloro-2,6-difluorophenyl)cyclopropyl]methanamine
SMILESNCC1(c2c(F)cc(Cl)cc2F)CC1
InChIInChI=1S/C10H10ClF2N/c11-6-3-7(12)9(8(13)4-6)10(5-14)1-2-10/h3-4H,1-2,5,14H2
InChIKeyOLIWKNIKKMSRFQ-UHFFFAOYSA-N
XLogP2.61
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.65
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[1-(4-chloro-2,6-difluorophenyl)cyclopentyl]methanamine
CID 117366660
[1-(3-chloro-2,4,6-trifluorophenyl)cyclopropyl]methanamine
CID 117343836
4-[1-(aminomethyl)cyclopentyl]-3,5-difluorophenol
CID 84791406
[1-(2-chloro-4,5-difluorophenyl)cyclopropyl]methanamine
CID 117310225
[1-(3-bromo-2,4,6-trifluorophenyl)cyclopentyl]methanamine
CID 117492969
[1-(2,6-difluorophenyl)cyclopentyl]methanamine
CID 47002854
2-[1-(aminomethyl)cyclopropyl]-3,4-difluoroaniline
CID 117047234
[1-(3-chloro-4-fluorophenyl)cyclopropyl]methanamine;methanol
CID 143403316
[1-(2,6-difluoro-4-methoxyphenyl)cyclohexyl]methanamine
CID 117391281
2-[1-(aminomethyl)cyclopropyl]-6-chloro-3-fluoro-4-methylphenol
CID 84793301
[1-(2-chloro-3-fluoro-6-methylphenyl)cyclobutyl]methanamine
CID 117327869
[1-(4-bromo-6-fluoro-2,3-dimethoxyphenyl)cyclopropyl]methanamine
CID 117489270

Frequently Asked Questions

What is the IUPAC name of [1-(4-chloro-2,6-difluorophenyl)cyclopropyl]methanamine?
The IUPAC name of [1-(4-chloro-2,6-difluorophenyl)cyclopropyl]methanamine (CID 117310224) is [1-(4-chloro-2,6-difluorophenyl)cyclopropyl]methanamine.
What is the SMILES notation for [1-(4-chloro-2,6-difluorophenyl)cyclopropyl]methanamine?
The canonical SMILES for [1-(4-chloro-2,6-difluorophenyl)cyclopropyl]methanamine is NCC1(c2c(F)cc(Cl)cc2F)CC1.
What is the InChIKey of [1-(4-chloro-2,6-difluorophenyl)cyclopropyl]methanamine?
The InChIKey is OLIWKNIKKMSRFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClF2N/c11-6-3-7(12)9(8(13)4-6)10(5-14)1-2-10/h3-4H,1-2,5,14H2.
What are the key properties of [1-(4-chloro-2,6-difluorophenyl)cyclopropyl]methanamine?
[1-(4-chloro-2,6-difluorophenyl)cyclopropyl]methanamine has a molecular weight of 217.65 g/mol, XLogP of 2.61, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-chloro-2,6-difluorophenyl)cyclopropyl]methanamine is sourced from PubChem (CID 117310224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).