7-cyclopropyl-1-methylindol-5-amine

C12H14N2 — CID 90152637

IUPAC7-cyclopropyl-1-methylindol-5-amine
SMILESCn1ccc2cc(N)cc(C3CC3)c21
InChIInChI=1S/C12H14N2/c1-14-5-4-9-6-10(13)7-11(12(9)14)8-2-3-8/h4-8H,2-3,13H2,1H3
InChIKeyJEPVDVBGKJTRCN-UHFFFAOYSA-N
MW186.26 g/mol
LogP2.64
Rot. Bonds1

About 7-cyclopropyl-1-methylindol-5-amine

7-cyclopropyl-1-methylindol-5-amine (PubChem CID 90152637) has the molecular formula C12H14N2 and a molecular weight of 186.26 g/mol. Its IUPAC name is 7-cyclopropyl-1-methylindol-5-amine.

Molecular Properties

Compound Name7-cyclopropyl-1-methylindol-5-amine
PubChem CID90152637
Molecular FormulaC12H14N2
Molecular Weight186.26 g/mol
Exact Mass186.12
IUPAC Name7-cyclopropyl-1-methylindol-5-amine
SMILESCn1ccc2cc(N)cc(C3CC3)c21
InChIInChI=1S/C12H14N2/c1-14-5-4-9-6-10(13)7-11(12(9)14)8-2-3-8/h4-8H,2-3,13H2,1H3
InChIKeyJEPVDVBGKJTRCN-UHFFFAOYSA-N
XLogP2.64
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.26
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 7-cyclopropyl-1-methylindol-5-amine?
The IUPAC name of 7-cyclopropyl-1-methylindol-5-amine (CID 90152637) is 7-cyclopropyl-1-methylindol-5-amine.
What is the SMILES notation for 7-cyclopropyl-1-methylindol-5-amine?
The canonical SMILES for 7-cyclopropyl-1-methylindol-5-amine is Cn1ccc2cc(N)cc(C3CC3)c21.
What is the InChIKey of 7-cyclopropyl-1-methylindol-5-amine?
The InChIKey is JEPVDVBGKJTRCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2/c1-14-5-4-9-6-10(13)7-11(12(9)14)8-2-3-8/h4-8H,2-3,13H2,1H3.
What are the key properties of 7-cyclopropyl-1-methylindol-5-amine?
7-cyclopropyl-1-methylindol-5-amine has a molecular weight of 186.26 g/mol, XLogP of 2.64, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-cyclopropyl-1-methylindol-5-amine is sourced from PubChem (CID 90152637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).