[1-[[[3-(4-chlorophenyl)cyclobutyl]amino]methyl]cyclopentyl]methanol

C17H24ClNO — CID 115358767

IUPAC[1-[[[3-(4-chlorophenyl)cyclobutyl]amino]methyl]cyclopentyl]methanol
SMILESOCC1(CNC2CC(c3ccc(Cl)cc3)C2)CCCC1
InChIInChI=1S/C17H24ClNO/c18-15-5-3-13(4-6-15)14-9-16(10-14)19-11-17(12-20)7-1-2-8-17/h3-6,14,16,19-20H,1-2,7-12H2
InChIKeyCXTUBQZKZLOHLS-UHFFFAOYSA-N
MW293.84 g/mol
LogP3.73
Rot. Bonds5

About [1-[[[3-(4-chlorophenyl)cyclobutyl]amino]methyl]cyclopentyl]methanol

[1-[[[3-(4-chlorophenyl)cyclobutyl]amino]methyl]cyclopentyl]methanol (PubChem CID 115358767) has the molecular formula C17H24ClNO and a molecular weight of 293.84 g/mol. Its IUPAC name is [1-[[[3-(4-chlorophenyl)cyclobutyl]amino]methyl]cyclopentyl]methanol.

Molecular Properties

Compound Name[1-[[[3-(4-chlorophenyl)cyclobutyl]amino]methyl]cyclopentyl]methanol
PubChem CID115358767
Molecular FormulaC17H24ClNO
Molecular Weight293.84 g/mol
Exact Mass293.15
IUPAC Name[1-[[[3-(4-chlorophenyl)cyclobutyl]amino]methyl]cyclopentyl]methanol
SMILESOCC1(CNC2CC(c3ccc(Cl)cc3)C2)CCCC1
InChIInChI=1S/C17H24ClNO/c18-15-5-3-13(4-6-15)14-9-16(10-14)19-11-17(12-20)7-1-2-8-17/h3-6,14,16,19-20H,1-2,7-12H2
InChIKeyCXTUBQZKZLOHLS-UHFFFAOYSA-N
XLogP3.73
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.84
LogP ≤ 53.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze [1-[[[3-(4-chlorophenyl)cyclobutyl]amino]methyl]cyclopentyl]methanol with MolForge

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Related Compounds

[1-[[[3-(4-chlorophenyl)cyclobutyl]amino]methyl]cyclohexyl]methanol
CID 103965853
1-[[[3-(4-chlorophenyl)cyclobutyl]amino]methyl]cyclopentan-1-ol
CID 65107309
[4-[[[3-(4-chlorophenyl)cyclobutyl]amino]methyl]phenyl]methanol
CID 107229852
2-[[3-(4-chlorophenyl)cyclobutyl]amino]acetic acid
CID 43635160
[1-[[(4-cyclopropylphenyl)methylamino]methyl]cyclohexyl]methanol
CID 103965842
2-[1-[[[3-(4-bromophenyl)cyclobutyl]amino]methyl]cyclopropyl]ethanol
CID 114756149
[1-[[(5-chloro-2,3-dihydro-1H-inden-1-yl)amino]methyl]cyclohexyl]methanol
CID 115892903
1-(4-chlorophenyl)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]cyclopropane-1-carboxamide
CID 115362498
3-(4-bromophenyl)-N-[2-(4-chlorophenyl)ethyl]cyclobutan-1-amine
CID 43634135
3-(4-chlorophenyl)-N-(3-phenylpropyl)cyclobutan-1-amine
CID 43634161
4-[[3-(4-chlorophenyl)cyclobutyl]amino]-3,3-dimethylbutan-1-ol
CID 104530299
3-(4-chlorophenyl)-N-(2-cyclohexylethyl)cyclobutan-1-amine
CID 63448300

Frequently Asked Questions

What is the IUPAC name of [1-[[[3-(4-chlorophenyl)cyclobutyl]amino]methyl]cyclopentyl]methanol?
The IUPAC name of [1-[[[3-(4-chlorophenyl)cyclobutyl]amino]methyl]cyclopentyl]methanol (CID 115358767) is [1-[[[3-(4-chlorophenyl)cyclobutyl]amino]methyl]cyclopentyl]methanol.
What is the SMILES notation for [1-[[[3-(4-chlorophenyl)cyclobutyl]amino]methyl]cyclopentyl]methanol?
The canonical SMILES for [1-[[[3-(4-chlorophenyl)cyclobutyl]amino]methyl]cyclopentyl]methanol is OCC1(CNC2CC(c3ccc(Cl)cc3)C2)CCCC1.
What is the InChIKey of [1-[[[3-(4-chlorophenyl)cyclobutyl]amino]methyl]cyclopentyl]methanol?
The InChIKey is CXTUBQZKZLOHLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24ClNO/c18-15-5-3-13(4-6-15)14-9-16(10-14)19-11-17(12-20)7-1-2-8-17/h3-6,14,16,19-20H,1-2,7-12H2.
What are the key properties of [1-[[[3-(4-chlorophenyl)cyclobutyl]amino]methyl]cyclopentyl]methanol?
[1-[[[3-(4-chlorophenyl)cyclobutyl]amino]methyl]cyclopentyl]methanol has a molecular weight of 293.84 g/mol, XLogP of 3.73, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[[3-(4-chlorophenyl)cyclobutyl]amino]methyl]cyclopentyl]methanol is sourced from PubChem (CID 115358767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).