N-ethyl-3-methylindol-1-amine

C11H14N2 — CID 119091648

IUPACN-ethyl-3-methylindol-1-amine
SMILESCCNn1cc(C)c2ccccc21
InChIInChI=1S/C11H14N2/c1-3-12-13-8-9(2)10-6-4-5-7-11(10)13/h4-8,12H,3H2,1-2H3
InChIKeyUJUPDKMGMAADLQ-UHFFFAOYSA-N
MW174.25 g/mol
LogP2.51
Rot. Bonds2

About N-ethyl-3-methylindol-1-amine

N-ethyl-3-methylindol-1-amine (PubChem CID 119091648) has the molecular formula C11H14N2 and a molecular weight of 174.25 g/mol. Its IUPAC name is N-ethyl-3-methylindol-1-amine.

Molecular Properties

Compound NameN-ethyl-3-methylindol-1-amine
PubChem CID119091648
Molecular FormulaC11H14N2
Molecular Weight174.25 g/mol
Exact Mass174.12
IUPAC NameN-ethyl-3-methylindol-1-amine
SMILESCCNn1cc(C)c2ccccc21
InChIInChI=1S/C11H14N2/c1-3-12-13-8-9(2)10-6-4-5-7-11(10)13/h4-8,12H,3H2,1-2H3
InChIKeyUJUPDKMGMAADLQ-UHFFFAOYSA-N
XLogP2.51
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.25
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3-methylindol-1-yl)methanol
CID 54090827
2-[(3-methylindol-1-yl)carbamoyl]benzoic acid
CID 19036965
2-methyl-N-[2-(3-methylindol-1-yl)ethyl]propan-2-amine
CID 62564838
1-benzyl-3-methylindole;ethane
CID 145343697
2-methyl-2-(3-methylindol-1-yl)propanoic acid
CID 114989239
methyl-(3-methylindol-1-yl)borinic acid
CID 58792281
3-(3-methylindol-1-yl)pentan-1-amine
CID 43428962
(3-methylindol-1-yl)methanesulfinate
CID 174435650
4-N-ethylfuro[3,2-b]pyrrole-4,6-diamine
CID 69462856
ethyl 2-hydroxy-2-(3-methylindol-1-yl)acetate
CID 138978169
3-methyl-1-nitroindole
CID 67256017
1-cyclopropyl-3-methylindole;ethane
CID 145207186

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-methylindol-1-amine?
The IUPAC name of N-ethyl-3-methylindol-1-amine (CID 119091648) is N-ethyl-3-methylindol-1-amine.
What is the SMILES notation for N-ethyl-3-methylindol-1-amine?
The canonical SMILES for N-ethyl-3-methylindol-1-amine is CCNn1cc(C)c2ccccc21.
What is the InChIKey of N-ethyl-3-methylindol-1-amine?
The InChIKey is UJUPDKMGMAADLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2/c1-3-12-13-8-9(2)10-6-4-5-7-11(10)13/h4-8,12H,3H2,1-2H3.
What are the key properties of N-ethyl-3-methylindol-1-amine?
N-ethyl-3-methylindol-1-amine has a molecular weight of 174.25 g/mol, XLogP of 2.51, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-methylindol-1-amine is sourced from PubChem (CID 119091648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).