N-(1H-indol-3-ylmethyl)-2-methoxycyclopentan-1-amine

C15H20N2O — CID 55062011

IUPACN-(1H-indol-3-ylmethyl)-2-methoxycyclopentan-1-amine
SMILESCOC1CCCC1NCc1c[nH]c2ccccc12
InChIInChI=1S/C15H20N2O/c1-18-15-8-4-7-14(15)17-10-11-9-16-13-6-3-2-5-12(11)13/h2-3,5-6,9,14-17H,4,7-8,10H2,1H3
InChIKeyYLIZXJFSDGMAEW-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.83
Rot. Bonds4

About N-(1H-indol-3-ylmethyl)-2-methoxycyclopentan-1-amine

N-(1H-indol-3-ylmethyl)-2-methoxycyclopentan-1-amine (PubChem CID 55062011) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is N-(1H-indol-3-ylmethyl)-2-methoxycyclopentan-1-amine.

Molecular Properties

Compound NameN-(1H-indol-3-ylmethyl)-2-methoxycyclopentan-1-amine
PubChem CID55062011
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC NameN-(1H-indol-3-ylmethyl)-2-methoxycyclopentan-1-amine
SMILESCOC1CCCC1NCc1c[nH]c2ccccc12
InChIInChI=1S/C15H20N2O/c1-18-15-8-4-7-14(15)17-10-11-9-16-13-6-3-2-5-12(11)13/h2-3,5-6,9,14-17H,4,7-8,10H2,1H3
InChIKeyYLIZXJFSDGMAEW-UHFFFAOYSA-N
XLogP2.83
TPSA37.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1H-indol-3-ylmethyl)-2-methylcyclopropan-1-amine
CID 62396352
N-(1-benzofuran-3-ylmethyl)-2-methoxycyclopentan-1-amine
CID 80701565
1-cyclobutyl-N-(1H-indol-3-ylmethyl)methanamine
CID 62332415
2-[[(2-methoxycyclopentyl)amino]methyl]-6-methylphenol
CID 112554340
cis-(1S,2R)-N-[(2S)-4-(1H-indol-3-yl)-4-methylpentan-2-yl]-2-methoxycyclopentan-1-amine
CID 124724954
N-(1H-indol-3-ylmethyl)-2,2-dimethylcyclopropan-1-amine
CID 61221927
N-[2-(1H-indol-3-yl)ethyl]-2,6-dimethylcyclohexan-1-amine
CID 43078792
N-(1H-indol-3-ylmethyl)-3,3,5,5-tetramethylcyclohexan-1-amine
CID 103965535
2-methoxy-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)cyclopentan-1-amine
CID 80649519
N-[(2-bromo-5-methoxyphenyl)methyl]-2-methoxycyclopentan-1-amine
CID 65324218
1-cyclohexyl-N-(1H-indol-3-ylmethyl)ethanamine
CID 62407326
N-(1H-indol-4-ylmethyl)-2-methylcyclohexan-1-amine
CID 62999891

Frequently Asked Questions

What is the IUPAC name of N-(1H-indol-3-ylmethyl)-2-methoxycyclopentan-1-amine?
The IUPAC name of N-(1H-indol-3-ylmethyl)-2-methoxycyclopentan-1-amine (CID 55062011) is N-(1H-indol-3-ylmethyl)-2-methoxycyclopentan-1-amine.
What is the SMILES notation for N-(1H-indol-3-ylmethyl)-2-methoxycyclopentan-1-amine?
The canonical SMILES for N-(1H-indol-3-ylmethyl)-2-methoxycyclopentan-1-amine is COC1CCCC1NCc1c[nH]c2ccccc12.
What is the InChIKey of N-(1H-indol-3-ylmethyl)-2-methoxycyclopentan-1-amine?
The InChIKey is YLIZXJFSDGMAEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-18-15-8-4-7-14(15)17-10-11-9-16-13-6-3-2-5-12(11)13/h2-3,5-6,9,14-17H,4,7-8,10H2,1H3.
What are the key properties of N-(1H-indol-3-ylmethyl)-2-methoxycyclopentan-1-amine?
N-(1H-indol-3-ylmethyl)-2-methoxycyclopentan-1-amine has a molecular weight of 244.34 g/mol, XLogP of 2.83, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indol-3-ylmethyl)-2-methoxycyclopentan-1-amine is sourced from PubChem (CID 55062011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).