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

C14H15ClN2 — CID 19036374

IUPAC1-(7-chloro-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine
SMILESCC(N)Cn1ccc2c1-c1cc(Cl)ccc1C2
InChIInChI=1S/C14H15ClN2/c1-9(16)8-17-5-4-11-6-10-2-3-12(15)7-13(10)14(11)17/h2-5,7,9H,6,8,16H2,1H3
InChIKeyXZJGQWAIMNQWOZ-UHFFFAOYSA-N
MW246.74 g/mol
LogP3.06
Rot. Bonds2

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

1-(7-chloro-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine (PubChem CID 19036374) has the molecular formula C14H15ClN2 and a molecular weight of 246.74 g/mol. Its IUPAC name is 1-(7-chloro-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine.

Molecular Properties

Compound Name1-(7-chloro-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine
PubChem CID19036374
Molecular FormulaC14H15ClN2
Molecular Weight246.74 g/mol
Exact Mass246.09
IUPAC Name1-(7-chloro-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine
SMILESCC(N)Cn1ccc2c1-c1cc(Cl)ccc1C2
InChIInChI=1S/C14H15ClN2/c1-9(16)8-17-5-4-11-6-10-2-3-12(15)7-13(10)14(11)17/h2-5,7,9H,6,8,16H2,1H3
InChIKeyXZJGQWAIMNQWOZ-UHFFFAOYSA-N
XLogP3.06
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.74
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(7-chloro-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine?
The IUPAC name of 1-(7-chloro-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine (CID 19036374) is 1-(7-chloro-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine.
What is the SMILES notation for 1-(7-chloro-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine?
The canonical SMILES for 1-(7-chloro-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine is CC(N)Cn1ccc2c1-c1cc(Cl)ccc1C2.
What is the InChIKey of 1-(7-chloro-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine?
The InChIKey is XZJGQWAIMNQWOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2/c1-9(16)8-17-5-4-11-6-10-2-3-12(15)7-13(10)14(11)17/h2-5,7,9H,6,8,16H2,1H3.
What are the key properties of 1-(7-chloro-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine?
1-(7-chloro-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine has a molecular weight of 246.74 g/mol, XLogP of 3.06, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-chloro-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine is sourced from PubChem (CID 19036374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).