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

C13H18N2 — CID 118600288

IUPACN,N,2,3,7-pentamethyl-1H-indol-4-amine
SMILESCc1[nH]c2c(C)ccc(N(C)C)c2c1C
InChIInChI=1S/C13H18N2/c1-8-6-7-11(15(4)5)12-9(2)10(3)14-13(8)12/h6-7,14H,1-5H3
InChIKeyUXDVFWRTGWUGPL-UHFFFAOYSA-N
MW202.30 g/mol
LogP3.16
Rot. Bonds1

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

N,N,2,3,7-pentamethyl-1H-indol-4-amine (PubChem CID 118600288) has the molecular formula C13H18N2 and a molecular weight of 202.30 g/mol. Its IUPAC name is N,N,2,3,7-pentamethyl-1H-indol-4-amine.

Molecular Properties

Compound NameN,N,2,3,7-pentamethyl-1H-indol-4-amine
PubChem CID118600288
Molecular FormulaC13H18N2
Molecular Weight202.30 g/mol
Exact Mass202.15
IUPAC NameN,N,2,3,7-pentamethyl-1H-indol-4-amine
SMILESCc1[nH]c2c(C)ccc(N(C)C)c2c1C
InChIInChI=1S/C13H18N2/c1-8-6-7-11(15(4)5)12-9(2)10(3)14-13(8)12/h6-7,14H,1-5H3
InChIKeyUXDVFWRTGWUGPL-UHFFFAOYSA-N
XLogP3.16
TPSA19.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,N,2,3,7-pentamethyl-1H-indol-4-amine?
The IUPAC name of N,N,2,3,7-pentamethyl-1H-indol-4-amine (CID 118600288) is N,N,2,3,7-pentamethyl-1H-indol-4-amine.
What is the SMILES notation for N,N,2,3,7-pentamethyl-1H-indol-4-amine?
The canonical SMILES for N,N,2,3,7-pentamethyl-1H-indol-4-amine is Cc1[nH]c2c(C)ccc(N(C)C)c2c1C.
What is the InChIKey of N,N,2,3,7-pentamethyl-1H-indol-4-amine?
The InChIKey is UXDVFWRTGWUGPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2/c1-8-6-7-11(15(4)5)12-9(2)10(3)14-13(8)12/h6-7,14H,1-5H3.
What are the key properties of N,N,2,3,7-pentamethyl-1H-indol-4-amine?
N,N,2,3,7-pentamethyl-1H-indol-4-amine has a molecular weight of 202.30 g/mol, XLogP of 3.16, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,2,3,7-pentamethyl-1H-indol-4-amine is sourced from PubChem (CID 118600288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).