2-[(cyclopentylamino)methyl]-1-methylindol-6-ol

C15H20N2O — CID 117180034

IUPAC2-[(cyclopentylamino)methyl]-1-methylindol-6-ol
SMILESCn1c(CNC2CCCC2)cc2ccc(O)cc21
InChIInChI=1S/C15H20N2O/c1-17-13(10-16-12-4-2-3-5-12)8-11-6-7-14(18)9-15(11)17/h6-9,12,16,18H,2-5,10H2,1H3
InChIKeyLDBYQUGTEQYPAH-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.92
Rot. Bonds3

About 2-[(cyclopentylamino)methyl]-1-methylindol-6-ol

2-[(cyclopentylamino)methyl]-1-methylindol-6-ol (PubChem CID 117180034) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 2-[(cyclopentylamino)methyl]-1-methylindol-6-ol.

Molecular Properties

Compound Name2-[(cyclopentylamino)methyl]-1-methylindol-6-ol
PubChem CID117180034
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name2-[(cyclopentylamino)methyl]-1-methylindol-6-ol
SMILESCn1c(CNC2CCCC2)cc2ccc(O)cc21
InChIInChI=1S/C15H20N2O/c1-17-13(10-16-12-4-2-3-5-12)8-11-6-7-14(18)9-15(11)17/h6-9,12,16,18H,2-5,10H2,1H3
InChIKeyLDBYQUGTEQYPAH-UHFFFAOYSA-N
XLogP2.92
TPSA37.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(cyclobutylamino)methyl]-1-methylindol-5-ol
CID 117176588
2-[(cyclopentylamino)methyl]-1-methylindol-6-amine
CID 117180033
N-[(1-methylindol-2-yl)methyl]cyclobutanamine
CID 117173088
2-[(cyclopropylamino)methyl]-1-propan-2-ylindol-6-ol
CID 117180534
N-[(5-chloro-1-methylindol-2-yl)methyl]cyclobutanamine
CID 117176590
N-[(4-chloro-1-methylindol-2-yl)methyl]cyclopentanamine
CID 117173103
N-[(1,5-dimethylpyrrol-2-yl)methyl]cyclopentanamine
CID 100792166
2-(ethylsulfonylmethyl)-1-methylindol-6-ol
CID 117180113
N-[(4-chloro-1-methylindol-2-yl)methyl]cyclobutanamine
CID 117173092
N-[[6-(aminomethyl)-1-propan-2-ylindol-2-yl]methyl]cyclopentanamine
CID 117180455
4-[(cyclopentylamino)methyl]phenol
CID 3873791
3-amino-4-[(cyclopentylamino)methyl]phenol
CID 117220836

Frequently Asked Questions

What is the IUPAC name of 2-[(cyclopentylamino)methyl]-1-methylindol-6-ol?
The IUPAC name of 2-[(cyclopentylamino)methyl]-1-methylindol-6-ol (CID 117180034) is 2-[(cyclopentylamino)methyl]-1-methylindol-6-ol.
What is the SMILES notation for 2-[(cyclopentylamino)methyl]-1-methylindol-6-ol?
The canonical SMILES for 2-[(cyclopentylamino)methyl]-1-methylindol-6-ol is Cn1c(CNC2CCCC2)cc2ccc(O)cc21.
What is the InChIKey of 2-[(cyclopentylamino)methyl]-1-methylindol-6-ol?
The InChIKey is LDBYQUGTEQYPAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-17-13(10-16-12-4-2-3-5-12)8-11-6-7-14(18)9-15(11)17/h6-9,12,16,18H,2-5,10H2,1H3.
What are the key properties of 2-[(cyclopentylamino)methyl]-1-methylindol-6-ol?
2-[(cyclopentylamino)methyl]-1-methylindol-6-ol has a molecular weight of 244.34 g/mol, XLogP of 2.92, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(cyclopentylamino)methyl]-1-methylindol-6-ol is sourced from PubChem (CID 117180034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).