6-chloro-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-2-amine

C10H10ClN3 — CID 115025604

IUPAC6-chloro-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-2-amine
SMILESNC1Cc2nc3cc(Cl)ccc3n2C1
InChIInChI=1S/C10H10ClN3/c11-6-1-2-9-8(3-6)13-10-4-7(12)5-14(9)10/h1-3,7H,4-5,12H2
InChIKeyCKKGWIRCIJHNBM-UHFFFAOYSA-N
MW207.66 g/mol
LogP1.57
Rot. Bonds

About 6-chloro-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-2-amine

6-chloro-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-2-amine (PubChem CID 115025604) has the molecular formula C10H10ClN3 and a molecular weight of 207.66 g/mol. Its IUPAC name is 6-chloro-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-2-amine.

Molecular Properties

Compound Name6-chloro-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-2-amine
PubChem CID115025604
Molecular FormulaC10H10ClN3
Molecular Weight207.66 g/mol
Exact Mass207.06
IUPAC Name6-chloro-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-2-amine
SMILESNC1Cc2nc3cc(Cl)ccc3n2C1
InChIInChI=1S/C10H10ClN3/c11-6-1-2-9-8(3-6)13-10-4-7(12)5-14(9)10/h1-3,7H,4-5,12H2
InChIKeyCKKGWIRCIJHNBM-UHFFFAOYSA-N
XLogP1.57
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.66
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-2-amine?
The IUPAC name of 6-chloro-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-2-amine (CID 115025604) is 6-chloro-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-2-amine.
What is the SMILES notation for 6-chloro-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-2-amine?
The canonical SMILES for 6-chloro-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-2-amine is NC1Cc2nc3cc(Cl)ccc3n2C1.
What is the InChIKey of 6-chloro-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-2-amine?
The InChIKey is CKKGWIRCIJHNBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClN3/c11-6-1-2-9-8(3-6)13-10-4-7(12)5-14(9)10/h1-3,7H,4-5,12H2.
What are the key properties of 6-chloro-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-2-amine?
6-chloro-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-2-amine has a molecular weight of 207.66 g/mol, XLogP of 1.57, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-2-amine is sourced from PubChem (CID 115025604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).