N-[2-(6-methyl-1H-indol-3-yl)ethyl]propan-2-amine

C14H20N2 — CID 82493176

IUPACN-[2-(6-methyl-1H-indol-3-yl)ethyl]propan-2-amine
SMILESCc1ccc2c(CCNC(C)C)c[nH]c2c1
InChIInChI=1S/C14H20N2/c1-10(2)15-7-6-12-9-16-14-8-11(3)4-5-13(12)14/h4-5,8-10,15-16H,6-7H2,1-3H3
InChIKeyJAQRETFWIOALBU-UHFFFAOYSA-N
MW216.33 g/mol
LogP3.02
Rot. Bonds4

About N-[2-(6-methyl-1H-indol-3-yl)ethyl]propan-2-amine

N-[2-(6-methyl-1H-indol-3-yl)ethyl]propan-2-amine (PubChem CID 82493176) has the molecular formula C14H20N2 and a molecular weight of 216.33 g/mol. Its IUPAC name is N-[2-(6-methyl-1H-indol-3-yl)ethyl]propan-2-amine.

Molecular Properties

Compound NameN-[2-(6-methyl-1H-indol-3-yl)ethyl]propan-2-amine
PubChem CID82493176
Molecular FormulaC14H20N2
Molecular Weight216.33 g/mol
Exact Mass216.16
IUPAC NameN-[2-(6-methyl-1H-indol-3-yl)ethyl]propan-2-amine
SMILESCc1ccc2c(CCNC(C)C)c[nH]c2c1
InChIInChI=1S/C14H20N2/c1-10(2)15-7-6-12-9-16-14-8-11(3)4-5-13(12)14/h4-5,8-10,15-16H,6-7H2,1-3H3
InChIKeyJAQRETFWIOALBU-UHFFFAOYSA-N
XLogP3.02
TPSA27.82 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.33
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

(1R)-N-[2-(6-methyl-1H-indol-3-yl)ethyl]-1-(oxan-4-yl)ethanamine
CID 97231176
N-[2-(6-methyl-1H-indol-3-yl)ethyl]-1-(oxan-4-yl)ethanamine
CID 84587801
N-[2-(6-methyl-1H-indol-3-yl)ethyl]cyclopentanamine
CID 82497315
2-methyl-1-[2-(6-methyl-1H-indol-3-yl)ethyl]-3-propan-2-ylguanidine;hydroiodide
CID 111127001
2,2-dimethyl-N-[2-(6-methyl-1H-indol-3-yl)ethyl]propan-1-amine
CID 119110585
1-(6-methyl-1H-indol-3-yl)propan-2-amine;hydrochloride
CID 117067481
N-[2-(3,6-dihydro-2H-[1,4]dioxino[2,3-f]indol-8-yl)ethyl]propan-2-amine
CID 82500566
N-methyl-1-(6-methyl-1H-indol-3-yl)methanamine
CID 68579797
2-methyl-1-[2-(6-methyl-1H-indol-3-yl)ethyl]-3-[2-[methyl(propan-2-yl)amino]ethyl]guanidine
CID 111973964
3-[2-(azetidin-1-yl)ethyl]-6-methyl-1H-indole
CID 169286723
1-[2-(6-fluoro-1H-indol-3-yl)ethyl]-3-[2-(6-methyl-1H-indol-3-yl)ethyl]urea
CID 86880994
1-ethyl-2-[2-(6-methyl-1H-indol-3-yl)ethyl]-3-propan-2-ylguanidine
CID 111126570

Frequently Asked Questions

What is the IUPAC name of N-[2-(6-methyl-1H-indol-3-yl)ethyl]propan-2-amine?
The IUPAC name of N-[2-(6-methyl-1H-indol-3-yl)ethyl]propan-2-amine (CID 82493176) is N-[2-(6-methyl-1H-indol-3-yl)ethyl]propan-2-amine.
What is the SMILES notation for N-[2-(6-methyl-1H-indol-3-yl)ethyl]propan-2-amine?
The canonical SMILES for N-[2-(6-methyl-1H-indol-3-yl)ethyl]propan-2-amine is Cc1ccc2c(CCNC(C)C)c[nH]c2c1.
What is the InChIKey of N-[2-(6-methyl-1H-indol-3-yl)ethyl]propan-2-amine?
The InChIKey is JAQRETFWIOALBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2/c1-10(2)15-7-6-12-9-16-14-8-11(3)4-5-13(12)14/h4-5,8-10,15-16H,6-7H2,1-3H3.
What are the key properties of N-[2-(6-methyl-1H-indol-3-yl)ethyl]propan-2-amine?
N-[2-(6-methyl-1H-indol-3-yl)ethyl]propan-2-amine has a molecular weight of 216.33 g/mol, XLogP of 3.02, 4 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(6-methyl-1H-indol-3-yl)ethyl]propan-2-amine is sourced from PubChem (CID 82493176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).