7-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-1-amine

C12H14N2 — CID 105442245

IUPAC7-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-1-amine
SMILESCc1ccc2cc3n(c2c1)C(N)CC3
InChIInChI=1S/C12H14N2/c1-8-2-3-9-7-10-4-5-12(13)14(10)11(9)6-8/h2-3,6-7,12H,4-5,13H2,1H3
InChIKeyXDGBGOCCLJPBTF-UHFFFAOYSA-N
MW186.26 g/mol
LogP2.35
Rot. Bonds

About 7-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-1-amine

7-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-1-amine (PubChem CID 105442245) has the molecular formula C12H14N2 and a molecular weight of 186.26 g/mol. Its IUPAC name is 7-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-1-amine.

Molecular Properties

Compound Name7-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-1-amine
PubChem CID105442245
Molecular FormulaC12H14N2
Molecular Weight186.26 g/mol
Exact Mass186.12
IUPAC Name7-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-1-amine
SMILESCc1ccc2cc3n(c2c1)C(N)CC3
InChIInChI=1S/C12H14N2/c1-8-2-3-9-7-10-4-5-12(13)14(10)11(9)6-8/h2-3,6-7,12H,4-5,13H2,1H3
InChIKeyXDGBGOCCLJPBTF-UHFFFAOYSA-N
XLogP2.35
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.26
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-1-amine?
The IUPAC name of 7-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-1-amine (CID 105442245) is 7-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-1-amine.
What is the SMILES notation for 7-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-1-amine?
The canonical SMILES for 7-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-1-amine is Cc1ccc2cc3n(c2c1)C(N)CC3.
What is the InChIKey of 7-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-1-amine?
The InChIKey is XDGBGOCCLJPBTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2/c1-8-2-3-9-7-10-4-5-12(13)14(10)11(9)6-8/h2-3,6-7,12H,4-5,13H2,1H3.
What are the key properties of 7-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-1-amine?
7-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-1-amine has a molecular weight of 186.26 g/mol, XLogP of 2.35, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-1-amine is sourced from PubChem (CID 105442245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).