1-[1-(5-methoxy-1-methylindol-4-yl)cyclopropyl]ethanamine

C15H20N2O — CID 117363094

IUPAC1-[1-(5-methoxy-1-methylindol-4-yl)cyclopropyl]ethanamine
SMILESCOc1ccc2c(ccn2C)c1C1(C(C)N)CC1
InChIInChI=1S/C15H20N2O/c1-10(16)15(7-8-15)14-11-6-9-17(2)12(11)4-5-13(14)18-3/h4-6,9-10H,7-8,16H2,1-3H3
InChIKeyLFKTYKSRWYCEHW-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.57
Rot. Bonds3

About 1-[1-(5-methoxy-1-methylindol-4-yl)cyclopropyl]ethanamine

1-[1-(5-methoxy-1-methylindol-4-yl)cyclopropyl]ethanamine (PubChem CID 117363094) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 1-[1-(5-methoxy-1-methylindol-4-yl)cyclopropyl]ethanamine.

Molecular Properties

Compound Name1-[1-(5-methoxy-1-methylindol-4-yl)cyclopropyl]ethanamine
PubChem CID117363094
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name1-[1-(5-methoxy-1-methylindol-4-yl)cyclopropyl]ethanamine
SMILESCOc1ccc2c(ccn2C)c1C1(C(C)N)CC1
InChIInChI=1S/C15H20N2O/c1-10(16)15(7-8-15)14-11-6-9-17(2)12(11)4-5-13(14)18-3/h4-6,9-10H,7-8,16H2,1-3H3
InChIKeyLFKTYKSRWYCEHW-UHFFFAOYSA-N
XLogP2.57
TPSA40.18 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'dyes5A(27)', 'substructure': 'N/A'}

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Related Compounds

[1-(5-methoxy-1-methylindol-4-yl)cyclopentyl]methanamine
CID 117399804
1-[1-(2-chloro-6-methoxyphenyl)cyclopropyl]ethanamine
CID 117324448
O-[(5-methoxy-1-methylindol-4-yl)methyl]hydroxylamine
CID 117294860
O-[2-(5-methoxy-1-methylindol-4-yl)ethyl]hydroxylamine
CID 117314453
1-[1-(6-bromo-3,4-dimethoxy-2-methylphenyl)cyclopropyl]ethanamine
CID 117499649
1-[1-(3-ethyl-2,4-dimethoxyphenyl)cyclopropyl]ethanamine
CID 117377084
1-[1-(3-methoxy-4-propan-2-ylphenyl)cyclopropyl]ethanamine
CID 117339161
methyl 2-(1-methylindol-4-yl)propanoate
CID 102374940
2-[1-(1-aminoethyl)cyclopropyl]-3-bromo-4-fluoro-6-methoxyphenol
CID 117489178
1-[1-(5-cyclopentyl-2-methoxyphenyl)cyclopropyl]ethanamine
CID 117402808
1-[1-[3-(difluoromethyl)-4-methoxyphenyl]cyclopropyl]ethanamine
CID 117355047
1-[1-(3-bromo-2-fluoro-4-methoxyphenyl)cyclopropyl]ethanamine
CID 117465009

Frequently Asked Questions

What is the IUPAC name of 1-[1-(5-methoxy-1-methylindol-4-yl)cyclopropyl]ethanamine?
The IUPAC name of 1-[1-(5-methoxy-1-methylindol-4-yl)cyclopropyl]ethanamine (CID 117363094) is 1-[1-(5-methoxy-1-methylindol-4-yl)cyclopropyl]ethanamine.
What is the SMILES notation for 1-[1-(5-methoxy-1-methylindol-4-yl)cyclopropyl]ethanamine?
The canonical SMILES for 1-[1-(5-methoxy-1-methylindol-4-yl)cyclopropyl]ethanamine is COc1ccc2c(ccn2C)c1C1(C(C)N)CC1.
What is the InChIKey of 1-[1-(5-methoxy-1-methylindol-4-yl)cyclopropyl]ethanamine?
The InChIKey is LFKTYKSRWYCEHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-10(16)15(7-8-15)14-11-6-9-17(2)12(11)4-5-13(14)18-3/h4-6,9-10H,7-8,16H2,1-3H3.
What are the key properties of 1-[1-(5-methoxy-1-methylindol-4-yl)cyclopropyl]ethanamine?
1-[1-(5-methoxy-1-methylindol-4-yl)cyclopropyl]ethanamine has a molecular weight of 244.34 g/mol, XLogP of 2.57, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(5-methoxy-1-methylindol-4-yl)cyclopropyl]ethanamine is sourced from PubChem (CID 117363094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).