N-[2-(4,6-dimethyl-1H-indol-3-yl)ethyl]-2-methylpropan-2-amine

C16H24N2 — CID 82497754

IUPACN-[2-(4,6-dimethyl-1H-indol-3-yl)ethyl]-2-methylpropan-2-amine
SMILESCc1cc(C)c2c(CCNC(C)(C)C)c[nH]c2c1
InChIInChI=1S/C16H24N2/c1-11-8-12(2)15-13(10-17-14(15)9-11)6-7-18-16(3,4)5/h8-10,17-18H,6-7H2,1-5H3
InChIKeyKWDUUMYWCXLPEK-UHFFFAOYSA-N
MW244.38 g/mol
LogP3.72
Rot. Bonds3

About N-[2-(4,6-dimethyl-1H-indol-3-yl)ethyl]-2-methylpropan-2-amine

N-[2-(4,6-dimethyl-1H-indol-3-yl)ethyl]-2-methylpropan-2-amine (PubChem CID 82497754) has the molecular formula C16H24N2 and a molecular weight of 244.38 g/mol. Its IUPAC name is N-[2-(4,6-dimethyl-1H-indol-3-yl)ethyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[2-(4,6-dimethyl-1H-indol-3-yl)ethyl]-2-methylpropan-2-amine
PubChem CID82497754
Molecular FormulaC16H24N2
Molecular Weight244.38 g/mol
Exact Mass244.19
IUPAC NameN-[2-(4,6-dimethyl-1H-indol-3-yl)ethyl]-2-methylpropan-2-amine
SMILESCc1cc(C)c2c(CCNC(C)(C)C)c[nH]c2c1
InChIInChI=1S/C16H24N2/c1-11-8-12(2)15-13(10-17-14(15)9-11)6-7-18-16(3,4)5/h8-10,17-18H,6-7H2,1-5H3
InChIKeyKWDUUMYWCXLPEK-UHFFFAOYSA-N
XLogP3.72
TPSA27.82 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 53.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-[2-(4,6-dimethyl-1H-indol-3-yl)ethyl]-2-methylpropan-2-amine?
The IUPAC name of N-[2-(4,6-dimethyl-1H-indol-3-yl)ethyl]-2-methylpropan-2-amine (CID 82497754) is N-[2-(4,6-dimethyl-1H-indol-3-yl)ethyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[2-(4,6-dimethyl-1H-indol-3-yl)ethyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[2-(4,6-dimethyl-1H-indol-3-yl)ethyl]-2-methylpropan-2-amine is Cc1cc(C)c2c(CCNC(C)(C)C)c[nH]c2c1.
What is the InChIKey of N-[2-(4,6-dimethyl-1H-indol-3-yl)ethyl]-2-methylpropan-2-amine?
The InChIKey is KWDUUMYWCXLPEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2/c1-11-8-12(2)15-13(10-17-14(15)9-11)6-7-18-16(3,4)5/h8-10,17-18H,6-7H2,1-5H3.
What are the key properties of N-[2-(4,6-dimethyl-1H-indol-3-yl)ethyl]-2-methylpropan-2-amine?
N-[2-(4,6-dimethyl-1H-indol-3-yl)ethyl]-2-methylpropan-2-amine has a molecular weight of 244.38 g/mol, XLogP of 3.72, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4,6-dimethyl-1H-indol-3-yl)ethyl]-2-methylpropan-2-amine is sourced from PubChem (CID 82497754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).