1-[(1H-indol-7-ylmethylamino)methyl]cyclopentan-1-ol

C15H20N2O — CID 113234393

IUPAC1-[(1H-indol-7-ylmethylamino)methyl]cyclopentan-1-ol
SMILESOC1(CNCc2cccc3cc[nH]c23)CCCC1
InChIInChI=1S/C15H20N2O/c18-15(7-1-2-8-15)11-16-10-13-5-3-4-12-6-9-17-14(12)13/h3-6,9,16-18H,1-2,7-8,10-11H2
InChIKeyGSDHLGFBGRKEAW-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.56
Rot. Bonds4

About 1-[(1H-indol-7-ylmethylamino)methyl]cyclopentan-1-ol

1-[(1H-indol-7-ylmethylamino)methyl]cyclopentan-1-ol (PubChem CID 113234393) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 1-[(1H-indol-7-ylmethylamino)methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[(1H-indol-7-ylmethylamino)methyl]cyclopentan-1-ol
PubChem CID113234393
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name1-[(1H-indol-7-ylmethylamino)methyl]cyclopentan-1-ol
SMILESOC1(CNCc2cccc3cc[nH]c23)CCCC1
InChIInChI=1S/C15H20N2O/c18-15(7-1-2-8-15)11-16-10-13-5-3-4-12-6-9-17-14(12)13/h3-6,9,16-18H,1-2,7-8,10-11H2
InChIKeyGSDHLGFBGRKEAW-UHFFFAOYSA-N
XLogP2.56
TPSA48.05 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.56
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(1H-indol-4-ylmethylamino)methyl]cyclobutan-1-ol
CID 111114552
[1-(1H-indol-7-ylmethylamino)cyclobutyl]methanol
CID 113263647
(2R)-1-(1H-indol-7-ylmethylamino)propan-2-ol
CID 96903920
2-(1H-indol-7-ylmethylamino)propane-1,3-diol
CID 115655450
1-[[(2-bromophenyl)methylamino]methyl]cyclopentan-1-ol
CID 63931838
2-fluoro-6-[[(1-hydroxycyclopentyl)methylamino]methyl]phenol
CID 112606953
2-bromo-6-[[(1-hydroxycyclopentyl)methylamino]methyl]phenol
CID 63934114
1-[(1H-indol-6-ylmethylamino)methyl]cyclohexan-1-ol
CID 102911180
N-(1H-indol-7-ylmethyl)hex-5-yn-1-amine
CID 103757748
2-cyclobutyl-N-(1H-indol-7-ylmethyl)ethanamine
CID 103748737
[2-[(1H-indol-7-ylmethylamino)methyl]cyclopentyl]methanol
CID 102911296
1-[(isoquinolin-5-ylmethylamino)methyl]cycloheptan-1-ol
CID 65123185

Frequently Asked Questions

What is the IUPAC name of 1-[(1H-indol-7-ylmethylamino)methyl]cyclopentan-1-ol?
The IUPAC name of 1-[(1H-indol-7-ylmethylamino)methyl]cyclopentan-1-ol (CID 113234393) is 1-[(1H-indol-7-ylmethylamino)methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[(1H-indol-7-ylmethylamino)methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[(1H-indol-7-ylmethylamino)methyl]cyclopentan-1-ol is OC1(CNCc2cccc3cc[nH]c23)CCCC1.
What is the InChIKey of 1-[(1H-indol-7-ylmethylamino)methyl]cyclopentan-1-ol?
The InChIKey is GSDHLGFBGRKEAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c18-15(7-1-2-8-15)11-16-10-13-5-3-4-12-6-9-17-14(12)13/h3-6,9,16-18H,1-2,7-8,10-11H2.
What are the key properties of 1-[(1H-indol-7-ylmethylamino)methyl]cyclopentan-1-ol?
1-[(1H-indol-7-ylmethylamino)methyl]cyclopentan-1-ol has a molecular weight of 244.34 g/mol, XLogP of 2.56, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1H-indol-7-ylmethylamino)methyl]cyclopentan-1-ol is sourced from PubChem (CID 113234393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).