(2R)-6-chloro-3,4-dihydro-2H-chromene-2-carboxamide

C10H10ClNO2 — CID 66893695

IUPAC(2R)-6-chloro-3,4-dihydro-2H-chromene-2-carboxamide
SMILESNC(=O)[C@H]1CCc2cc(Cl)ccc2O1
InChIInChI=1S/C10H10ClNO2/c11-7-2-4-8-6(5-7)1-3-9(14-8)10(12)13/h2,4-5,9H,1,3H2,(H2,12,13)/t9-/m1/s1
InChIKeyLXVDNHLFYXSAHN-SECBINFHSA-N
MW211.65 g/mol
LogP1.52
Rot. Bonds1

About (2R)-6-chloro-3,4-dihydro-2H-chromene-2-carboxamide

(2R)-6-chloro-3,4-dihydro-2H-chromene-2-carboxamide (PubChem CID 66893695) has the molecular formula C10H10ClNO2 and a molecular weight of 211.65 g/mol. Its IUPAC name is (2R)-6-chloro-3,4-dihydro-2H-chromene-2-carboxamide.

Molecular Properties

Compound Name(2R)-6-chloro-3,4-dihydro-2H-chromene-2-carboxamide
PubChem CID66893695
Molecular FormulaC10H10ClNO2
Molecular Weight211.65 g/mol
Exact Mass211.04
IUPAC Name(2R)-6-chloro-3,4-dihydro-2H-chromene-2-carboxamide
SMILESNC(=O)[C@H]1CCc2cc(Cl)ccc2O1
InChIInChI=1S/C10H10ClNO2/c11-7-2-4-8-6(5-7)1-3-9(14-8)10(12)13/h2,4-5,9H,1,3H2,(H2,12,13)/t9-/m1/s1
InChIKeyLXVDNHLFYXSAHN-SECBINFHSA-N
XLogP1.52
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.65
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-6-chloro-3,4-dihydro-2H-chromene-2-carboxamide?
The IUPAC name of (2R)-6-chloro-3,4-dihydro-2H-chromene-2-carboxamide (CID 66893695) is (2R)-6-chloro-3,4-dihydro-2H-chromene-2-carboxamide.
What is the SMILES notation for (2R)-6-chloro-3,4-dihydro-2H-chromene-2-carboxamide?
The canonical SMILES for (2R)-6-chloro-3,4-dihydro-2H-chromene-2-carboxamide is NC(=O)[C@H]1CCc2cc(Cl)ccc2O1.
What is the InChIKey of (2R)-6-chloro-3,4-dihydro-2H-chromene-2-carboxamide?
The InChIKey is LXVDNHLFYXSAHN-SECBINFHSA-N. The full InChI is InChI=1S/C10H10ClNO2/c11-7-2-4-8-6(5-7)1-3-9(14-8)10(12)13/h2,4-5,9H,1,3H2,(H2,12,13)/t9-/m1/s1.
What are the key properties of (2R)-6-chloro-3,4-dihydro-2H-chromene-2-carboxamide?
(2R)-6-chloro-3,4-dihydro-2H-chromene-2-carboxamide has a molecular weight of 211.65 g/mol, XLogP of 1.52, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-6-chloro-3,4-dihydro-2H-chromene-2-carboxamide is sourced from PubChem (CID 66893695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).