N,N-dimethyl-2-(1-methylindol-3-yl)ethanamine

C13H18N2 — CID 25927

IUPACN,N-dimethyl-2-(1-methylindol-3-yl)ethanamine
SMILESCN(C)CCc1cn(C)c2ccccc12
InChIInChI=1S/C13H18N2/c1-14(2)9-8-11-10-15(3)13-7-5-4-6-12(11)13/h4-7,10H,8-9H2,1-3H3
InChIKeyWYFWKMQPMCPKLZ-UHFFFAOYSA-N
MW202.30 g/mol
LogP2.28
Rot. Bonds3

About N,N-dimethyl-2-(1-methylindol-3-yl)ethanamine

N,N-dimethyl-2-(1-methylindol-3-yl)ethanamine (PubChem CID 25927) has the molecular formula C13H18N2 and a molecular weight of 202.30 g/mol. Its IUPAC name is N,N-dimethyl-2-(1-methylindol-3-yl)ethanamine.

Molecular Properties

Compound NameN,N-dimethyl-2-(1-methylindol-3-yl)ethanamine
PubChem CID25927
Molecular FormulaC13H18N2
Molecular Weight202.30 g/mol
Exact Mass202.15
IUPAC NameN,N-dimethyl-2-(1-methylindol-3-yl)ethanamine
SMILESCN(C)CCc1cn(C)c2ccccc12
InChIInChI=1S/C13H18N2/c1-14(2)9-8-11-10-15(3)13-7-5-4-6-12(11)13/h4-7,10H,8-9H2,1-3H3
InChIKeyWYFWKMQPMCPKLZ-UHFFFAOYSA-N
XLogP2.28
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(1-methylindol-3-yl)ethanamine?
The IUPAC name of N,N-dimethyl-2-(1-methylindol-3-yl)ethanamine (CID 25927) is N,N-dimethyl-2-(1-methylindol-3-yl)ethanamine.
What is the SMILES notation for N,N-dimethyl-2-(1-methylindol-3-yl)ethanamine?
The canonical SMILES for N,N-dimethyl-2-(1-methylindol-3-yl)ethanamine is CN(C)CCc1cn(C)c2ccccc12.
What is the InChIKey of N,N-dimethyl-2-(1-methylindol-3-yl)ethanamine?
The InChIKey is WYFWKMQPMCPKLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2/c1-14(2)9-8-11-10-15(3)13-7-5-4-6-12(11)13/h4-7,10H,8-9H2,1-3H3.
What are the key properties of N,N-dimethyl-2-(1-methylindol-3-yl)ethanamine?
N,N-dimethyl-2-(1-methylindol-3-yl)ethanamine has a molecular weight of 202.30 g/mol, XLogP of 2.28, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(1-methylindol-3-yl)ethanamine is sourced from PubChem (CID 25927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).