1-(7-ethyl-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine

C16H20N2 — CID 19036448

IUPAC1-(7-ethyl-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine
SMILESCCc1ccc2c(c1)-c1c(ccn1CC(C)N)C2
InChIInChI=1S/C16H20N2/c1-3-12-4-5-13-9-14-6-7-18(10-11(2)17)16(14)15(13)8-12/h4-8,11H,3,9-10,17H2,1-2H3
InChIKeyKXGMUCAOWWXRIF-UHFFFAOYSA-N
MW240.35 g/mol
LogP2.97
Rot. Bonds3

About 1-(7-ethyl-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine

1-(7-ethyl-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine (PubChem CID 19036448) has the molecular formula C16H20N2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 1-(7-ethyl-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine.

Molecular Properties

Compound Name1-(7-ethyl-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine
PubChem CID19036448
Molecular FormulaC16H20N2
Molecular Weight240.35 g/mol
Exact Mass240.16
IUPAC Name1-(7-ethyl-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine
SMILESCCc1ccc2c(c1)-c1c(ccn1CC(C)N)C2
InChIInChI=1S/C16H20N2/c1-3-12-4-5-13-9-14-6-7-18(10-11(2)17)16(14)15(13)8-12/h4-8,11H,3,9-10,17H2,1-2H3
InChIKeyKXGMUCAOWWXRIF-UHFFFAOYSA-N
XLogP2.97
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(7-ethyl-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine?
The IUPAC name of 1-(7-ethyl-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine (CID 19036448) is 1-(7-ethyl-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine.
What is the SMILES notation for 1-(7-ethyl-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine?
The canonical SMILES for 1-(7-ethyl-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine is CCc1ccc2c(c1)-c1c(ccn1CC(C)N)C2.
What is the InChIKey of 1-(7-ethyl-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine?
The InChIKey is KXGMUCAOWWXRIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2/c1-3-12-4-5-13-9-14-6-7-18(10-11(2)17)16(14)15(13)8-12/h4-8,11H,3,9-10,17H2,1-2H3.
What are the key properties of 1-(7-ethyl-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine?
1-(7-ethyl-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine has a molecular weight of 240.35 g/mol, XLogP of 2.97, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-ethyl-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine is sourced from PubChem (CID 19036448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).