1-(1-ethyl-7-methylindol-2-yl)propan-2-amine

C14H20N2 — CID 117196697

IUPAC1-(1-ethyl-7-methylindol-2-yl)propan-2-amine
SMILESCCn1c(CC(C)N)cc2cccc(C)c21
InChIInChI=1S/C14H20N2/c1-4-16-13(8-11(3)15)9-12-7-5-6-10(2)14(12)16/h5-7,9,11H,4,8,15H2,1-3H3
InChIKeyHYNSUKVSWKEYQC-UHFFFAOYSA-N
MW216.33 g/mol
LogP2.86
Rot. Bonds3

About 1-(1-ethyl-7-methylindol-2-yl)propan-2-amine

1-(1-ethyl-7-methylindol-2-yl)propan-2-amine (PubChem CID 117196697) has the molecular formula C14H20N2 and a molecular weight of 216.33 g/mol. Its IUPAC name is 1-(1-ethyl-7-methylindol-2-yl)propan-2-amine.

Molecular Properties

Compound Name1-(1-ethyl-7-methylindol-2-yl)propan-2-amine
PubChem CID117196697
Molecular FormulaC14H20N2
Molecular Weight216.33 g/mol
Exact Mass216.16
IUPAC Name1-(1-ethyl-7-methylindol-2-yl)propan-2-amine
SMILESCCn1c(CC(C)N)cc2cccc(C)c21
InChIInChI=1S/C14H20N2/c1-4-16-13(8-11(3)15)9-12-7-5-6-10(2)14(12)16/h5-7,9,11H,4,8,15H2,1-3H3
InChIKeyHYNSUKVSWKEYQC-UHFFFAOYSA-N
XLogP2.86
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.33
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(1-ethyl-7-methylindol-2-yl)-2-methylpropanoic acid
CID 117196710
1-(1,7-dimethylindol-2-yl)butan-2-amine;hydrochloride
CID 170890669
1-ethyl-2-[(3-methoxyphenoxy)methyl]-7-methylindole
CID 117186591
1-[1-ethyl-5-(trifluoromethyl)indol-2-yl]propan-2-amine
CID 117121456
3-(1-ethyl-7-fluoroindol-2-yl)-2-methylpropanoic acid
CID 117196993
1-[1-ethyl-7-(trifluoromethyl)indol-2-yl]-N-methylpropan-2-amine
CID 117196602
2-(ethylsulfanylmethyl)-7-methyl-1-propan-2-ylindole
CID 117186618
1-ethyl-2-(propan-2-yloxymethyl)indol-7-ol
CID 117184262
2-(1-ethyl-7-methylindol-2-yl)-2-methylpropanoic acid
CID 117196706
1-ethyl-7-fluoro-2-(propan-2-yloxymethyl)indole
CID 117184270
3-(1,7-dimethylindol-2-yl)-2-methylpropanoic acid
CID 83859980
(2R)-1-(2,6-dimethylphenyl)propan-2-amine;hydrochloride
CID 175702028

Frequently Asked Questions

What is the IUPAC name of 1-(1-ethyl-7-methylindol-2-yl)propan-2-amine?
The IUPAC name of 1-(1-ethyl-7-methylindol-2-yl)propan-2-amine (CID 117196697) is 1-(1-ethyl-7-methylindol-2-yl)propan-2-amine.
What is the SMILES notation for 1-(1-ethyl-7-methylindol-2-yl)propan-2-amine?
The canonical SMILES for 1-(1-ethyl-7-methylindol-2-yl)propan-2-amine is CCn1c(CC(C)N)cc2cccc(C)c21.
What is the InChIKey of 1-(1-ethyl-7-methylindol-2-yl)propan-2-amine?
The InChIKey is HYNSUKVSWKEYQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2/c1-4-16-13(8-11(3)15)9-12-7-5-6-10(2)14(12)16/h5-7,9,11H,4,8,15H2,1-3H3.
What are the key properties of 1-(1-ethyl-7-methylindol-2-yl)propan-2-amine?
1-(1-ethyl-7-methylindol-2-yl)propan-2-amine has a molecular weight of 216.33 g/mol, XLogP of 2.86, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethyl-7-methylindol-2-yl)propan-2-amine is sourced from PubChem (CID 117196697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).