N-(1H-indol-7-ylmethyl)-2-methoxy-2-methylpropan-1-amine

C14H20N2O — CID 113243504

IUPACN-(1H-indol-7-ylmethyl)-2-methoxy-2-methylpropan-1-amine
SMILESCOC(C)(C)CNCc1cccc2cc[nH]c12
InChIInChI=1S/C14H20N2O/c1-14(2,17-3)10-15-9-12-6-4-5-11-7-8-16-13(11)12/h4-8,15-16H,9-10H2,1-3H3
InChIKeyUGXXZKHVVYJBOJ-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.68
Rot. Bonds5

About N-(1H-indol-7-ylmethyl)-2-methoxy-2-methylpropan-1-amine

N-(1H-indol-7-ylmethyl)-2-methoxy-2-methylpropan-1-amine (PubChem CID 113243504) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is N-(1H-indol-7-ylmethyl)-2-methoxy-2-methylpropan-1-amine.

Molecular Properties

Compound NameN-(1H-indol-7-ylmethyl)-2-methoxy-2-methylpropan-1-amine
PubChem CID113243504
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC NameN-(1H-indol-7-ylmethyl)-2-methoxy-2-methylpropan-1-amine
SMILESCOC(C)(C)CNCc1cccc2cc[nH]c12
InChIInChI=1S/C14H20N2O/c1-14(2,17-3)10-15-9-12-6-4-5-11-7-8-16-13(11)12/h4-8,15-16H,9-10H2,1-3H3
InChIKeyUGXXZKHVVYJBOJ-UHFFFAOYSA-N
XLogP2.68
TPSA37.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(1H-indol-7-ylmethyl)-2-methoxy-2-methylpropan-1-amine 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

(2R)-1-(1H-indol-7-ylmethylamino)propan-2-ol
CID 96903920
N-(1H-indol-7-ylmethyl)-3,3-dimethylbutan-2-amine
CID 113234819
1-(1H-indol-7-yl)-N-(1H-pyrazol-4-ylmethyl)methanamine
CID 102847635
7-(2,2-dimethylpropyl)-1H-indole
CID 69029945
N-(1H-indol-7-ylmethyl)-2-methylsulfanylethanamine;hydrochloride
CID 115606849
N-[(4-fluoro-3,5-dimethylphenyl)methyl]-1-(1H-indol-7-yl)methanamine
CID 103748728
methyl 2-(1H-indol-7-ylmethylamino)benzoate
CID 102909440
7-[(2-methylpropan-2-yl)oxymethyl]-1H-indole
CID 59674725
N-(1H-indol-7-ylmethyl)-5-methylhexan-1-amine
CID 113240682
2-(1H-indol-7-ylmethylamino)-N-methylacetamide
CID 103640761
2-butoxy-N-(1H-indol-7-ylmethyl)ethanamine
CID 113230724
2-cyclobutyl-N-(1H-indol-7-ylmethyl)ethanamine
CID 103748737

Frequently Asked Questions

What is the IUPAC name of N-(1H-indol-7-ylmethyl)-2-methoxy-2-methylpropan-1-amine?
The IUPAC name of N-(1H-indol-7-ylmethyl)-2-methoxy-2-methylpropan-1-amine (CID 113243504) is N-(1H-indol-7-ylmethyl)-2-methoxy-2-methylpropan-1-amine.
What is the SMILES notation for N-(1H-indol-7-ylmethyl)-2-methoxy-2-methylpropan-1-amine?
The canonical SMILES for N-(1H-indol-7-ylmethyl)-2-methoxy-2-methylpropan-1-amine is COC(C)(C)CNCc1cccc2cc[nH]c12.
What is the InChIKey of N-(1H-indol-7-ylmethyl)-2-methoxy-2-methylpropan-1-amine?
The InChIKey is UGXXZKHVVYJBOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-14(2,17-3)10-15-9-12-6-4-5-11-7-8-16-13(11)12/h4-8,15-16H,9-10H2,1-3H3.
What are the key properties of N-(1H-indol-7-ylmethyl)-2-methoxy-2-methylpropan-1-amine?
N-(1H-indol-7-ylmethyl)-2-methoxy-2-methylpropan-1-amine has a molecular weight of 232.33 g/mol, XLogP of 2.68, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indol-7-ylmethyl)-2-methoxy-2-methylpropan-1-amine is sourced from PubChem (CID 113243504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).