[3-[(8-tricyclo[5.2.1.02,6]decanylamino)methyl]phenyl]methanol;hydrochloride

C18H26ClNO — CID 139951785

IUPAC[3-[(8-tricyclo[5.2.1.02,6]decanylamino)methyl]phenyl]methanol;hydrochloride
SMILESCl.OCc1cccc(CNC2CC3CC2C2CCCC32)c1
InChIInChI=1S/C18H25NO.ClH/c20-11-13-4-1-3-12(7-13)10-19-18-9-14-8-17(18)16-6-2-5-15(14)16;/h1,3-4,7,14-20H,2,5-6,8-11H2;1H
InChIKeyQGUWPYUIMUBZMW-UHFFFAOYSA-N
MW307.86 g/mol
LogP3.52
Rot. Bonds4

About [3-[(8-tricyclo[5.2.1.02,6]decanylamino)methyl]phenyl]methanol;hydrochloride

[3-[(8-tricyclo[5.2.1.02,6]decanylamino)methyl]phenyl]methanol;hydrochloride (PubChem CID 139951785) has the molecular formula C18H26ClNO and a molecular weight of 307.86 g/mol. Its IUPAC name is [3-[(8-tricyclo[5.2.1.02,6]decanylamino)methyl]phenyl]methanol;hydrochloride.

Molecular Properties

Compound Name[3-[(8-tricyclo[5.2.1.02,6]decanylamino)methyl]phenyl]methanol;hydrochloride
PubChem CID139951785
Molecular FormulaC18H26ClNO
Molecular Weight307.86 g/mol
Exact Mass307.17
IUPAC Name[3-[(8-tricyclo[5.2.1.02,6]decanylamino)methyl]phenyl]methanol;hydrochloride
SMILESCl.OCc1cccc(CNC2CC3CC2C2CCCC32)c1
InChIInChI=1S/C18H25NO.ClH/c20-11-13-4-1-3-12(7-13)10-19-18-9-14-8-17(18)16-6-2-5-15(14)16;/h1,3-4,7,14-20H,2,5-6,8-11H2;1H
InChIKeyQGUWPYUIMUBZMW-UHFFFAOYSA-N
XLogP3.52
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.86
LogP ≤ 53.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze [3-[(8-tricyclo[5.2.1.02,6]decanylamino)methyl]phenyl]methanol;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

(1S,2R,6R,7S,8R)-N-[(3-chlorophenyl)methyl]tricyclo[5.2.1.02,6]decan-8-amine
CID 15523767
(1R,2R,6S,7S,8R)-N-[(3-chlorophenyl)methyl]tricyclo[5.2.1.02,6]decan-8-amine
CID 18557367
(1S,2R,6R,7S,8R)-N-[[3-(2-methoxyethoxy)phenyl]methyl]tricyclo[5.2.1.02,6]decan-8-amine
CID 15523776
4-[(8-tricyclo[5.2.1.02,6]decanylamino)methyl]benzoic acid
CID 65347724
N-[(4-methoxyphenyl)methyl]tricyclo[5.2.1.02,6]decan-8-amine
CID 43392190
2-fluoro-6-[(8-tricyclo[5.2.1.02,6]decanylamino)methyl]phenol
CID 115951364
N-[2-(3-methylphenyl)ethyl]tricyclo[5.2.1.02,6]decan-8-amine
CID 63477283
N-[(1-ethylpyrrol-3-yl)methyl]tricyclo[5.2.1.02,6]decan-8-amine
CID 66413966
[3-[[(2-morpholin-3-ylcyclopentyl)amino]methyl]phenyl]methanol
CID 120914335
N-(pyridin-2-ylmethyl)tricyclo[5.2.1.02,6]decan-8-amine
CID 20726962
4-[[3-(hydroxymethyl)phenyl]methylamino]oxolan-3-ol
CID 107230514
(1R,2R,6S,7R,8S)-N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]tricyclo[5.2.1.02,6]decan-8-amine
CID 11946796

Frequently Asked Questions

What is the IUPAC name of [3-[(8-tricyclo[5.2.1.02,6]decanylamino)methyl]phenyl]methanol;hydrochloride?
The IUPAC name of [3-[(8-tricyclo[5.2.1.02,6]decanylamino)methyl]phenyl]methanol;hydrochloride (CID 139951785) is [3-[(8-tricyclo[5.2.1.02,6]decanylamino)methyl]phenyl]methanol;hydrochloride.
What is the SMILES notation for [3-[(8-tricyclo[5.2.1.02,6]decanylamino)methyl]phenyl]methanol;hydrochloride?
The canonical SMILES for [3-[(8-tricyclo[5.2.1.02,6]decanylamino)methyl]phenyl]methanol;hydrochloride is Cl.OCc1cccc(CNC2CC3CC2C2CCCC32)c1.
What is the InChIKey of [3-[(8-tricyclo[5.2.1.02,6]decanylamino)methyl]phenyl]methanol;hydrochloride?
The InChIKey is QGUWPYUIMUBZMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25NO.ClH/c20-11-13-4-1-3-12(7-13)10-19-18-9-14-8-17(18)16-6-2-5-15(14)16;/h1,3-4,7,14-20H,2,5-6,8-11H2;1H.
What are the key properties of [3-[(8-tricyclo[5.2.1.02,6]decanylamino)methyl]phenyl]methanol;hydrochloride?
[3-[(8-tricyclo[5.2.1.02,6]decanylamino)methyl]phenyl]methanol;hydrochloride has a molecular weight of 307.86 g/mol, XLogP of 3.52, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(8-tricyclo[5.2.1.02,6]decanylamino)methyl]phenyl]methanol;hydrochloride is sourced from PubChem (CID 139951785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).