N-[(2-methoxyphenyl)methyl]cyclooctanamine;hydrochloride

C16H26ClNO — CID 17331524

IUPACN-[(2-methoxyphenyl)methyl]cyclooctanamine;hydrochloride
SMILESCOc1ccccc1CNC1CCCCCCC1.Cl
InChIInChI=1S/C16H25NO.ClH/c1-18-16-12-8-7-9-14(16)13-17-15-10-5-3-2-4-6-11-15;/h7-9,12,15,17H,2-6,10-11,13H2,1H3;1H
InChIKeySFVHUKOMNBWMGU-UHFFFAOYSA-N
MW283.84 g/mol
LogP4.32
Rot. Bonds4

About N-[(2-methoxyphenyl)methyl]cyclooctanamine;hydrochloride

N-[(2-methoxyphenyl)methyl]cyclooctanamine;hydrochloride (PubChem CID 17331524) has the molecular formula C16H26ClNO and a molecular weight of 283.84 g/mol. Its IUPAC name is N-[(2-methoxyphenyl)methyl]cyclooctanamine;hydrochloride.

Molecular Properties

Compound NameN-[(2-methoxyphenyl)methyl]cyclooctanamine;hydrochloride
PubChem CID17331524
Molecular FormulaC16H26ClNO
Molecular Weight283.84 g/mol
Exact Mass283.17
IUPAC NameN-[(2-methoxyphenyl)methyl]cyclooctanamine;hydrochloride
SMILESCOc1ccccc1CNC1CCCCCCC1.Cl
InChIInChI=1S/C16H25NO.ClH/c1-18-16-12-8-7-9-14(16)13-17-15-10-5-3-2-4-6-11-15;/h7-9,12,15,17H,2-6,10-11,13H2,1H3;1H
InChIKeySFVHUKOMNBWMGU-UHFFFAOYSA-N
XLogP4.32
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.84
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[(2-methoxyphenyl)methyl]cyclooctanamine;hydrochloride 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

N-[(2-ethoxyphenyl)methyl]cyclohexanamine;hydrochloride
CID 6460007
trans-(1R,2R)-1-N,2-N-bis[(2-methoxyphenyl)methyl]cyclohexane-1,2-diamine
CID 71414214
N-[(2,3-dimethoxyphenyl)methyl]cyclopentanamine;hydrobromide
CID 75531449
N-[(2,4-dimethoxyphenyl)methyl]cyclododecanamine;hydrochloride
CID 21435442
N-[[2-[(2-fluorophenyl)methoxy]-3-methoxyphenyl]methyl]cycloheptanamine;hydrochloride
CID 17294905
N-[(2-ethoxy-3-methoxyphenyl)methyl]cyclopentanamine
CID 4717334
N-[(2,3-dimethoxyphenyl)methyl]cyclopropanamine;hydrochloride
CID 17295654
N-cyclopentyloxy-1-(2-methoxyphenyl)methanamine
CID 83229129
N-[(2,5-dimethoxyphenyl)methyl]cyclopentanamine
CID 792687
N-[(5-bromo-2-methoxyphenyl)methyl]cycloheptanamine
CID 792004
N-[(2,4,5-trimethoxyphenyl)methyl]cycloheptanamine
CID 787242
2-[2-[(cyclooctylamino)methyl]-6-methoxyphenoxy]acetamide;hydrochloride
CID 17053366

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxyphenyl)methyl]cyclooctanamine;hydrochloride?
The IUPAC name of N-[(2-methoxyphenyl)methyl]cyclooctanamine;hydrochloride (CID 17331524) is N-[(2-methoxyphenyl)methyl]cyclooctanamine;hydrochloride.
What is the SMILES notation for N-[(2-methoxyphenyl)methyl]cyclooctanamine;hydrochloride?
The canonical SMILES for N-[(2-methoxyphenyl)methyl]cyclooctanamine;hydrochloride is COc1ccccc1CNC1CCCCCCC1.Cl.
What is the InChIKey of N-[(2-methoxyphenyl)methyl]cyclooctanamine;hydrochloride?
The InChIKey is SFVHUKOMNBWMGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO.ClH/c1-18-16-12-8-7-9-14(16)13-17-15-10-5-3-2-4-6-11-15;/h7-9,12,15,17H,2-6,10-11,13H2,1H3;1H.
What are the key properties of N-[(2-methoxyphenyl)methyl]cyclooctanamine;hydrochloride?
N-[(2-methoxyphenyl)methyl]cyclooctanamine;hydrochloride has a molecular weight of 283.84 g/mol, XLogP of 4.32, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxyphenyl)methyl]cyclooctanamine;hydrochloride is sourced from PubChem (CID 17331524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).