2-(2-chlorophenyl)-1-(cyclobutylmethyl)cyclopropan-1-amine

C14H18ClN — CID 84699179

IUPAC2-(2-chlorophenyl)-1-(cyclobutylmethyl)cyclopropan-1-amine
SMILESNC1(CC2CCC2)CC1c1ccccc1Cl
InChIInChI=1S/C14H18ClN/c15-13-7-2-1-6-11(13)12-9-14(12,16)8-10-4-3-5-10/h1-2,6-7,10,12H,3-5,8-9,16H2
InChIKeyAJCCTOPAYJUQPJ-UHFFFAOYSA-N
MW235.76 g/mol
LogP3.71
Rot. Bonds3

About 2-(2-chlorophenyl)-1-(cyclobutylmethyl)cyclopropan-1-amine

2-(2-chlorophenyl)-1-(cyclobutylmethyl)cyclopropan-1-amine (PubChem CID 84699179) has the molecular formula C14H18ClN and a molecular weight of 235.76 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-1-(cyclobutylmethyl)cyclopropan-1-amine.

Molecular Properties

Compound Name2-(2-chlorophenyl)-1-(cyclobutylmethyl)cyclopropan-1-amine
PubChem CID84699179
Molecular FormulaC14H18ClN
Molecular Weight235.76 g/mol
Exact Mass235.11
IUPAC Name2-(2-chlorophenyl)-1-(cyclobutylmethyl)cyclopropan-1-amine
SMILESNC1(CC2CCC2)CC1c1ccccc1Cl
InChIInChI=1S/C14H18ClN/c15-13-7-2-1-6-11(13)12-9-14(12,16)8-10-4-3-5-10/h1-2,6-7,10,12H,3-5,8-9,16H2
InChIKeyAJCCTOPAYJUQPJ-UHFFFAOYSA-N
XLogP3.71
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.76
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

CID 25223
CID 25223
CID 65477
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CID 10007
CID 10007
CID 66361
CID 66361
CID 16049437
CID 16049437
CID 44572165
CID 44572165
CID 44572748
CID 44572748
CID 118730203
CID 118730203
CID 118730213
CID 118730213
CID 118730219
CID 118730219
CID 118730226
CID 118730226
CID 118730242
CID 118730242

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-1-(cyclobutylmethyl)cyclopropan-1-amine?
The IUPAC name of 2-(2-chlorophenyl)-1-(cyclobutylmethyl)cyclopropan-1-amine (CID 84699179) is 2-(2-chlorophenyl)-1-(cyclobutylmethyl)cyclopropan-1-amine.
What is the SMILES notation for 2-(2-chlorophenyl)-1-(cyclobutylmethyl)cyclopropan-1-amine?
The canonical SMILES for 2-(2-chlorophenyl)-1-(cyclobutylmethyl)cyclopropan-1-amine is NC1(CC2CCC2)CC1c1ccccc1Cl.
What is the InChIKey of 2-(2-chlorophenyl)-1-(cyclobutylmethyl)cyclopropan-1-amine?
The InChIKey is AJCCTOPAYJUQPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18ClN/c15-13-7-2-1-6-11(13)12-9-14(12,16)8-10-4-3-5-10/h1-2,6-7,10,12H,3-5,8-9,16H2.
What are the key properties of 2-(2-chlorophenyl)-1-(cyclobutylmethyl)cyclopropan-1-amine?
2-(2-chlorophenyl)-1-(cyclobutylmethyl)cyclopropan-1-amine has a molecular weight of 235.76 g/mol, XLogP of 3.71, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-1-(cyclobutylmethyl)cyclopropan-1-amine is sourced from PubChem (CID 84699179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).