N,2,3,7-tetramethyl-1H-indol-4-amine

C12H16N2 — CID 118600283

IUPACN,2,3,7-tetramethyl-1H-indol-4-amine
SMILESCNc1ccc(C)c2[nH]c(C)c(C)c12
InChIInChI=1S/C12H16N2/c1-7-5-6-10(13-4)11-8(2)9(3)14-12(7)11/h5-6,13-14H,1-4H3
InChIKeyPXIJASILESMXKB-UHFFFAOYSA-N
MW188.27 g/mol
LogP3.13
Rot. Bonds1

About N,2,3,7-tetramethyl-1H-indol-4-amine

N,2,3,7-tetramethyl-1H-indol-4-amine (PubChem CID 118600283) has the molecular formula C12H16N2 and a molecular weight of 188.27 g/mol. Its IUPAC name is N,2,3,7-tetramethyl-1H-indol-4-amine.

Molecular Properties

Compound NameN,2,3,7-tetramethyl-1H-indol-4-amine
PubChem CID118600283
Molecular FormulaC12H16N2
Molecular Weight188.27 g/mol
Exact Mass188.13
IUPAC NameN,2,3,7-tetramethyl-1H-indol-4-amine
SMILESCNc1ccc(C)c2[nH]c(C)c(C)c12
InChIInChI=1S/C12H16N2/c1-7-5-6-10(13-4)11-8(2)9(3)14-12(7)11/h5-6,13-14H,1-4H3
InChIKeyPXIJASILESMXKB-UHFFFAOYSA-N
XLogP3.13
TPSA27.82 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 53.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,2,3,7-tetramethyl-1H-indol-4-amine?
The IUPAC name of N,2,3,7-tetramethyl-1H-indol-4-amine (CID 118600283) is N,2,3,7-tetramethyl-1H-indol-4-amine.
What is the SMILES notation for N,2,3,7-tetramethyl-1H-indol-4-amine?
The canonical SMILES for N,2,3,7-tetramethyl-1H-indol-4-amine is CNc1ccc(C)c2[nH]c(C)c(C)c12.
What is the InChIKey of N,2,3,7-tetramethyl-1H-indol-4-amine?
The InChIKey is PXIJASILESMXKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2/c1-7-5-6-10(13-4)11-8(2)9(3)14-12(7)11/h5-6,13-14H,1-4H3.
What are the key properties of N,2,3,7-tetramethyl-1H-indol-4-amine?
N,2,3,7-tetramethyl-1H-indol-4-amine has a molecular weight of 188.27 g/mol, XLogP of 3.13, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,3,7-tetramethyl-1H-indol-4-amine is sourced from PubChem (CID 118600283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).