[1-(1,2,4,7-tetramethylindol-3-yl)cyclopentyl]methanamine

C18H26N2 — CID 96679133

IUPAC[1-(1,2,4,7-tetramethylindol-3-yl)cyclopentyl]methanamine
SMILESCc1ccc(C)c2c1c(C1(CN)CCCC1)c(C)n2C
InChIInChI=1S/C18H26N2/c1-12-7-8-13(2)17-15(12)16(14(3)20(17)4)18(11-19)9-5-6-10-18/h7-8H,5-6,9-11,19H2,1-4H3
InChIKeyBCMQCBKGTPCZTD-UHFFFAOYSA-N
MW270.42 g/mol
LogP3.87
Rot. Bonds2

About [1-(1,2,4,7-tetramethylindol-3-yl)cyclopentyl]methanamine

[1-(1,2,4,7-tetramethylindol-3-yl)cyclopentyl]methanamine (PubChem CID 96679133) has the molecular formula C18H26N2 and a molecular weight of 270.42 g/mol. Its IUPAC name is [1-(1,2,4,7-tetramethylindol-3-yl)cyclopentyl]methanamine.

Molecular Properties

Compound Name[1-(1,2,4,7-tetramethylindol-3-yl)cyclopentyl]methanamine
PubChem CID96679133
Molecular FormulaC18H26N2
Molecular Weight270.42 g/mol
Exact Mass270.21
IUPAC Name[1-(1,2,4,7-tetramethylindol-3-yl)cyclopentyl]methanamine
SMILESCc1ccc(C)c2c1c(C1(CN)CCCC1)c(C)n2C
InChIInChI=1S/C18H26N2/c1-12-7-8-13(2)17-15(12)16(14(3)20(17)4)18(11-19)9-5-6-10-18/h7-8H,5-6,9-11,19H2,1-4H3
InChIKeyBCMQCBKGTPCZTD-UHFFFAOYSA-N
XLogP3.87
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[1-(1,2-dimethylindol-3-yl)cyclopentyl]methanamine
CID 82497283
[1-(2,6-difluoro-3-methylphenyl)cyclopentyl]methanamine
CID 117323755
[1-(5-chloro-1,2-dimethylindol-3-yl)cyclopentyl]methanamine
CID 98034385
2-[1-(aminomethyl)cyclopentyl]-3,4-dimethylphenol
CID 117312988
[1-(3-chloro-2-fluoro-6-methylphenyl)cyclopentyl]methanamine
CID 84801366
[1-(6-chloro-2,3-dimethylphenyl)cyclohexyl]methanamine
CID 117382961
[1-(3-bromo-2-fluoro-6-methylphenyl)cyclopentyl]methanamine
CID 84813724
[1-(5-chloro-1,2-dimethylindol-3-yl)cyclobutyl]methanamine
CID 82666568
2-[1-(aminomethyl)cyclohexyl]-3-bromo-6-methylphenol
CID 117480430
2-[1-(aminomethyl)cyclopentyl]-3-chloro-4-methylphenol
CID 84800201
[1-(2-fluoro-6-methoxy-3-methylphenyl)cyclohexyl]methanamine
CID 117382107
[1-(3-fluoro-2-methoxy-6-methylphenyl)cyclopentyl]methanamine
CID 117347431

Frequently Asked Questions

What is the IUPAC name of [1-(1,2,4,7-tetramethylindol-3-yl)cyclopentyl]methanamine?
The IUPAC name of [1-(1,2,4,7-tetramethylindol-3-yl)cyclopentyl]methanamine (CID 96679133) is [1-(1,2,4,7-tetramethylindol-3-yl)cyclopentyl]methanamine.
What is the SMILES notation for [1-(1,2,4,7-tetramethylindol-3-yl)cyclopentyl]methanamine?
The canonical SMILES for [1-(1,2,4,7-tetramethylindol-3-yl)cyclopentyl]methanamine is Cc1ccc(C)c2c1c(C1(CN)CCCC1)c(C)n2C.
What is the InChIKey of [1-(1,2,4,7-tetramethylindol-3-yl)cyclopentyl]methanamine?
The InChIKey is BCMQCBKGTPCZTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2/c1-12-7-8-13(2)17-15(12)16(14(3)20(17)4)18(11-19)9-5-6-10-18/h7-8H,5-6,9-11,19H2,1-4H3.
What are the key properties of [1-(1,2,4,7-tetramethylindol-3-yl)cyclopentyl]methanamine?
[1-(1,2,4,7-tetramethylindol-3-yl)cyclopentyl]methanamine has a molecular weight of 270.42 g/mol, XLogP of 3.87, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1,2,4,7-tetramethylindol-3-yl)cyclopentyl]methanamine is sourced from PubChem (CID 96679133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).