[1-(2,6,7-trimethyl-1H-indol-3-yl)cyclopropyl]methanamine

C15H20N2 — CID 82494845

IUPAC[1-(2,6,7-trimethyl-1H-indol-3-yl)cyclopropyl]methanamine
SMILESCc1ccc2c(C3(CN)CC3)c(C)[nH]c2c1C
InChIInChI=1S/C15H20N2/c1-9-4-5-12-13(15(8-16)6-7-15)11(3)17-14(12)10(9)2/h4-5,17H,6-8,16H2,1-3H3
InChIKeyNOCYUPLCYCWDFY-UHFFFAOYSA-N
MW228.34 g/mol
LogP3.08
Rot. Bonds2

About [1-(2,6,7-trimethyl-1H-indol-3-yl)cyclopropyl]methanamine

[1-(2,6,7-trimethyl-1H-indol-3-yl)cyclopropyl]methanamine (PubChem CID 82494845) has the molecular formula C15H20N2 and a molecular weight of 228.34 g/mol. Its IUPAC name is [1-(2,6,7-trimethyl-1H-indol-3-yl)cyclopropyl]methanamine.

Molecular Properties

Compound Name[1-(2,6,7-trimethyl-1H-indol-3-yl)cyclopropyl]methanamine
PubChem CID82494845
Molecular FormulaC15H20N2
Molecular Weight228.34 g/mol
Exact Mass228.16
IUPAC Name[1-(2,6,7-trimethyl-1H-indol-3-yl)cyclopropyl]methanamine
SMILESCc1ccc2c(C3(CN)CC3)c(C)[nH]c2c1C
InChIInChI=1S/C15H20N2/c1-9-4-5-12-13(15(8-16)6-7-15)11(3)17-14(12)10(9)2/h4-5,17H,6-8,16H2,1-3H3
InChIKeyNOCYUPLCYCWDFY-UHFFFAOYSA-N
XLogP3.08
TPSA41.81 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

[4-(7-fluoro-2-methyl-1H-indol-3-yl)oxan-4-yl]methanamine
CID 82278444
[1-(6-bromo-2,3-dimethylphenyl)cyclopropyl]methanamine
CID 117388160
[1-(2,3,4-trimethylphenyl)cyclopropyl]methanamine
CID 116963513
[1-(2-methoxy-3,4-dimethylphenyl)cyclopropyl]methanamine
CID 117293943
2-[1-(aminomethyl)cyclopentyl]-3,4-dimethylphenol
CID 117312988
N-methyl-3-(2,6,7-trimethyl-1H-indol-3-yl)propan-1-amine
CID 82495253
[1-(6-chloro-2,3-dimethylphenyl)cyclohexyl]methanamine
CID 117382961
[1-(4-methyl-3-phenylphenyl)cyclopropyl]methanamine
CID 117347743
[1-(6-chloro-2-fluoro-3-methylphenyl)cyclopropyl]methanamine
CID 117304722
[1-(3-methoxy-1,4-dimethyl-5,6,7,8-tetrahydronaphthalen-2-yl)cyclopropyl]methanamine
CID 117402949
[1-[2-methyl-6-(trifluoromethyl)phenyl]cyclopropyl]methanamine
CID 117330254
3-[1-(aminomethyl)cyclopropyl]-4-bromo-2,6-dimethylphenol
CID 117428377

Frequently Asked Questions

What is the IUPAC name of [1-(2,6,7-trimethyl-1H-indol-3-yl)cyclopropyl]methanamine?
The IUPAC name of [1-(2,6,7-trimethyl-1H-indol-3-yl)cyclopropyl]methanamine (CID 82494845) is [1-(2,6,7-trimethyl-1H-indol-3-yl)cyclopropyl]methanamine.
What is the SMILES notation for [1-(2,6,7-trimethyl-1H-indol-3-yl)cyclopropyl]methanamine?
The canonical SMILES for [1-(2,6,7-trimethyl-1H-indol-3-yl)cyclopropyl]methanamine is Cc1ccc2c(C3(CN)CC3)c(C)[nH]c2c1C.
What is the InChIKey of [1-(2,6,7-trimethyl-1H-indol-3-yl)cyclopropyl]methanamine?
The InChIKey is NOCYUPLCYCWDFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2/c1-9-4-5-12-13(15(8-16)6-7-15)11(3)17-14(12)10(9)2/h4-5,17H,6-8,16H2,1-3H3.
What are the key properties of [1-(2,6,7-trimethyl-1H-indol-3-yl)cyclopropyl]methanamine?
[1-(2,6,7-trimethyl-1H-indol-3-yl)cyclopropyl]methanamine has a molecular weight of 228.34 g/mol, XLogP of 3.08, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,6,7-trimethyl-1H-indol-3-yl)cyclopropyl]methanamine is sourced from PubChem (CID 82494845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).