[2-(5-chloro-2-methoxyphenyl)spiro[3.5]nonan-2-yl]methanamine

C17H24ClNO — CID 65007249

IUPAC[2-(5-chloro-2-methoxyphenyl)spiro[3.5]nonan-2-yl]methanamine
SMILESCOc1ccc(Cl)cc1C1(CN)CC2(CCCCC2)C1
InChIInChI=1S/C17H24ClNO/c1-20-15-6-5-13(18)9-14(15)17(12-19)10-16(11-17)7-3-2-4-8-16/h5-6,9H,2-4,7-8,10-12,19H2,1H3
InChIKeyWLEXTARIMBXCKL-UHFFFAOYSA-N
MW293.84 g/mol
LogP4.29
Rot. Bonds3

About [2-(5-chloro-2-methoxyphenyl)spiro[3.5]nonan-2-yl]methanamine

[2-(5-chloro-2-methoxyphenyl)spiro[3.5]nonan-2-yl]methanamine (PubChem CID 65007249) has the molecular formula C17H24ClNO and a molecular weight of 293.84 g/mol. Its IUPAC name is [2-(5-chloro-2-methoxyphenyl)spiro[3.5]nonan-2-yl]methanamine.

Molecular Properties

Compound Name[2-(5-chloro-2-methoxyphenyl)spiro[3.5]nonan-2-yl]methanamine
PubChem CID65007249
Molecular FormulaC17H24ClNO
Molecular Weight293.84 g/mol
Exact Mass293.15
IUPAC Name[2-(5-chloro-2-methoxyphenyl)spiro[3.5]nonan-2-yl]methanamine
SMILESCOc1ccc(Cl)cc1C1(CN)CC2(CCCCC2)C1
InChIInChI=1S/C17H24ClNO/c1-20-15-6-5-13(18)9-14(15)17(12-19)10-16(11-17)7-3-2-4-8-16/h5-6,9H,2-4,7-8,10-12,19H2,1H3
InChIKeyWLEXTARIMBXCKL-UHFFFAOYSA-N
XLogP4.29
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.84
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [2-(5-chloro-2-methoxyphenyl)spiro[3.5]nonan-2-yl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(5-chloro-2-methoxyphenyl)spiro[3.4]octan-2-amine
CID 65002776
[2-(5-chloro-2-methoxyphenyl)-1,3-dioxan-2-yl]methanamine
CID 82132431
[5-(2-methoxyphenyl)spiro[2.3]hexan-5-yl]methanamine
CID 65008172
N-[[1-(5-chloro-2-methoxyphenyl)cyclohexyl]methyl]-2-methylpropan-2-amine
CID 63512396
1-[2-(5-chloro-2-methoxyphenyl)-7-oxaspiro[3.5]nonan-2-yl]-N-methylmethanamine
CID 65006264
2-(5-chloro-2-methoxyphenyl)spiro[3.3]heptane-2-carbonitrile
CID 65009591
[1-(5-tert-butyl-2-methoxyphenyl)cyclohexyl]methanamine
CID 98033979
1-(5-chloro-2-methoxyphenyl)cyclobutan-1-amine
CID 43146587
[2-(3-chlorophenyl)spiro[3.6]decan-2-yl]methanamine
CID 65007393
[1-(4-chloro-2,5-dimethoxyphenyl)cyclohexyl]methanamine
CID 117456502
[2-(3-methoxy-4-methylphenyl)spiro[3.4]octan-2-yl]methanamine
CID 65002969
[1-(5-chloro-4-fluoro-2-methoxyphenyl)cyclohexyl]methanamine
CID 117432368

Frequently Asked Questions

What is the IUPAC name of [2-(5-chloro-2-methoxyphenyl)spiro[3.5]nonan-2-yl]methanamine?
The IUPAC name of [2-(5-chloro-2-methoxyphenyl)spiro[3.5]nonan-2-yl]methanamine (CID 65007249) is [2-(5-chloro-2-methoxyphenyl)spiro[3.5]nonan-2-yl]methanamine.
What is the SMILES notation for [2-(5-chloro-2-methoxyphenyl)spiro[3.5]nonan-2-yl]methanamine?
The canonical SMILES for [2-(5-chloro-2-methoxyphenyl)spiro[3.5]nonan-2-yl]methanamine is COc1ccc(Cl)cc1C1(CN)CC2(CCCCC2)C1.
What is the InChIKey of [2-(5-chloro-2-methoxyphenyl)spiro[3.5]nonan-2-yl]methanamine?
The InChIKey is WLEXTARIMBXCKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24ClNO/c1-20-15-6-5-13(18)9-14(15)17(12-19)10-16(11-17)7-3-2-4-8-16/h5-6,9H,2-4,7-8,10-12,19H2,1H3.
What are the key properties of [2-(5-chloro-2-methoxyphenyl)spiro[3.5]nonan-2-yl]methanamine?
[2-(5-chloro-2-methoxyphenyl)spiro[3.5]nonan-2-yl]methanamine has a molecular weight of 293.84 g/mol, XLogP of 4.29, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(5-chloro-2-methoxyphenyl)spiro[3.5]nonan-2-yl]methanamine is sourced from PubChem (CID 65007249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).