(2R)-2-(6-chloro-9H-carbazol-2-yl)propanoic acid

C15H12ClNO2 — CID 6997572

IUPAC(2R)-2-(6-chloro-9H-carbazol-2-yl)propanoic acid
SMILESC[C@@H](C(=O)O)c1ccc2c(c1)[nH]c1ccc(Cl)cc12
InChIInChI=1S/C15H12ClNO2/c1-8(15(18)19)9-2-4-11-12-7-10(16)3-5-13(12)17-14(11)6-9/h2-8,17H,1H3,(H,18,19)/t8-/m1/s1
InChIKeyPUXBGTOOZJQSKH-MRVPVSSYSA-N
MW273.72 g/mol
LogP4.16
Rot. Bonds2

About (2R)-2-(6-chloro-9H-carbazol-2-yl)propanoic acid

(2R)-2-(6-chloro-9H-carbazol-2-yl)propanoic acid (PubChem CID 6997572) has the molecular formula C15H12ClNO2 and a molecular weight of 273.72 g/mol. Its IUPAC name is (2R)-2-(6-chloro-9H-carbazol-2-yl)propanoic acid.

Molecular Properties

Compound Name(2R)-2-(6-chloro-9H-carbazol-2-yl)propanoic acid
PubChem CID6997572
Molecular FormulaC15H12ClNO2
Molecular Weight273.72 g/mol
Exact Mass273.06
IUPAC Name(2R)-2-(6-chloro-9H-carbazol-2-yl)propanoic acid
SMILESC[C@@H](C(=O)O)c1ccc2c(c1)[nH]c1ccc(Cl)cc12
InChIInChI=1S/C15H12ClNO2/c1-8(15(18)19)9-2-4-11-12-7-10(16)3-5-13(12)17-14(11)6-9/h2-8,17H,1H3,(H,18,19)/t8-/m1/s1
InChIKeyPUXBGTOOZJQSKH-MRVPVSSYSA-N
XLogP4.16
TPSA53.09 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.72
LogP ≤ 54.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze (2R)-2-(6-chloro-9H-carbazol-2-yl)propanoic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(6-chloro-9H-carbazol-2-yl)propanoic acid?
The IUPAC name of (2R)-2-(6-chloro-9H-carbazol-2-yl)propanoic acid (CID 6997572) is (2R)-2-(6-chloro-9H-carbazol-2-yl)propanoic acid.
What is the SMILES notation for (2R)-2-(6-chloro-9H-carbazol-2-yl)propanoic acid?
The canonical SMILES for (2R)-2-(6-chloro-9H-carbazol-2-yl)propanoic acid is C[C@@H](C(=O)O)c1ccc2c(c1)[nH]c1ccc(Cl)cc12.
What is the InChIKey of (2R)-2-(6-chloro-9H-carbazol-2-yl)propanoic acid?
The InChIKey is PUXBGTOOZJQSKH-MRVPVSSYSA-N. The full InChI is InChI=1S/C15H12ClNO2/c1-8(15(18)19)9-2-4-11-12-7-10(16)3-5-13(12)17-14(11)6-9/h2-8,17H,1H3,(H,18,19)/t8-/m1/s1.
What are the key properties of (2R)-2-(6-chloro-9H-carbazol-2-yl)propanoic acid?
(2R)-2-(6-chloro-9H-carbazol-2-yl)propanoic acid has a molecular weight of 273.72 g/mol, XLogP of 4.16, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(6-chloro-9H-carbazol-2-yl)propanoic acid is sourced from PubChem (CID 6997572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).