N-[4-fluoro-7-(2-hydroxyethyl)-9H-carbazol-1-yl]formamide

C15H13FN2O2 — CID 175312802

IUPACN-[4-fluoro-7-(2-hydroxyethyl)-9H-carbazol-1-yl]formamide
SMILESO=CNc1ccc(F)c2c1[nH]c1cc(CCO)ccc12
InChIInChI=1S/C15H13FN2O2/c16-11-3-4-12(17-8-20)15-14(11)10-2-1-9(5-6-19)7-13(10)18-15/h1-4,7-8,18-19H,5-6H2,(H,17,20)
InChIKeyDDYCRFKWMAJCSW-UHFFFAOYSA-N
MW272.28 g/mol
LogP2.56
Rot. Bonds4

About N-[4-fluoro-7-(2-hydroxyethyl)-9H-carbazol-1-yl]formamide

N-[4-fluoro-7-(2-hydroxyethyl)-9H-carbazol-1-yl]formamide (PubChem CID 175312802) has the molecular formula C15H13FN2O2 and a molecular weight of 272.28 g/mol. Its IUPAC name is N-[4-fluoro-7-(2-hydroxyethyl)-9H-carbazol-1-yl]formamide.

Molecular Properties

Compound NameN-[4-fluoro-7-(2-hydroxyethyl)-9H-carbazol-1-yl]formamide
PubChem CID175312802
Molecular FormulaC15H13FN2O2
Molecular Weight272.28 g/mol
Exact Mass272.10
IUPAC NameN-[4-fluoro-7-(2-hydroxyethyl)-9H-carbazol-1-yl]formamide
SMILESO=CNc1ccc(F)c2c1[nH]c1cc(CCO)ccc12
InChIInChI=1S/C15H13FN2O2/c16-11-3-4-12(17-8-20)15-14(11)10-2-1-9(5-6-19)7-13(10)18-15/h1-4,7-8,18-19H,5-6H2,(H,17,20)
InChIKeyDDYCRFKWMAJCSW-UHFFFAOYSA-N
XLogP2.56
TPSA65.12 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.28
LogP ≤ 52.56
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[4-fluoro-7-(2-hydroxyethyl)-9H-carbazol-1-yl]formamide?
The IUPAC name of N-[4-fluoro-7-(2-hydroxyethyl)-9H-carbazol-1-yl]formamide (CID 175312802) is N-[4-fluoro-7-(2-hydroxyethyl)-9H-carbazol-1-yl]formamide.
What is the SMILES notation for N-[4-fluoro-7-(2-hydroxyethyl)-9H-carbazol-1-yl]formamide?
The canonical SMILES for N-[4-fluoro-7-(2-hydroxyethyl)-9H-carbazol-1-yl]formamide is O=CNc1ccc(F)c2c1[nH]c1cc(CCO)ccc12.
What is the InChIKey of N-[4-fluoro-7-(2-hydroxyethyl)-9H-carbazol-1-yl]formamide?
The InChIKey is DDYCRFKWMAJCSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FN2O2/c16-11-3-4-12(17-8-20)15-14(11)10-2-1-9(5-6-19)7-13(10)18-15/h1-4,7-8,18-19H,5-6H2,(H,17,20).
What are the key properties of N-[4-fluoro-7-(2-hydroxyethyl)-9H-carbazol-1-yl]formamide?
N-[4-fluoro-7-(2-hydroxyethyl)-9H-carbazol-1-yl]formamide has a molecular weight of 272.28 g/mol, XLogP of 2.56, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-fluoro-7-(2-hydroxyethyl)-9H-carbazol-1-yl]formamide is sourced from PubChem (CID 175312802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).