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

C16H24N2 — CID 26903

IUPACN-[2-(1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine
SMILESCC(C)N(CCc1c[nH]c2ccccc12)C(C)C
InChIInChI=1S/C16H24N2/c1-12(2)18(13(3)4)10-9-14-11-17-16-8-6-5-7-15(14)16/h5-8,11-13,17H,9-10H2,1-4H3
InChIKeyZRVAAGAZUWXRIP-UHFFFAOYSA-N
MW244.38 g/mol
LogP3.83
Rot. Bonds5

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

N-[2-(1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine (PubChem CID 26903) has the molecular formula C16H24N2 and a molecular weight of 244.38 g/mol. Its IUPAC name is N-[2-(1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine.

Molecular Properties

Compound NameN-[2-(1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine
PubChem CID26903
Molecular FormulaC16H24N2
Molecular Weight244.38 g/mol
Exact Mass244.19
IUPAC NameN-[2-(1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine
SMILESCC(C)N(CCc1c[nH]c2ccccc12)C(C)C
InChIInChI=1S/C16H24N2/c1-12(2)18(13(3)4)10-9-14-11-17-16-8-6-5-7-15(14)16/h5-8,11-13,17H,9-10H2,1-4H3
InChIKeyZRVAAGAZUWXRIP-UHFFFAOYSA-N
XLogP3.83
TPSA19.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-[2-(1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine?
The IUPAC name of N-[2-(1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine (CID 26903) is N-[2-(1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine.
What is the SMILES notation for N-[2-(1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine?
The canonical SMILES for N-[2-(1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine is CC(C)N(CCc1c[nH]c2ccccc12)C(C)C.
What is the InChIKey of N-[2-(1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine?
The InChIKey is ZRVAAGAZUWXRIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2/c1-12(2)18(13(3)4)10-9-14-11-17-16-8-6-5-7-15(14)16/h5-8,11-13,17H,9-10H2,1-4H3.
What are the key properties of N-[2-(1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine?
N-[2-(1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine has a molecular weight of 244.38 g/mol, XLogP of 3.83, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine is sourced from PubChem (CID 26903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).