N-(2,3-dihydroxypropyl)-9H-carbazole-3-carboxamide

C16H16N2O3 — CID 3148374

IUPACN-(2,3-dihydroxypropyl)-9H-carbazole-3-carboxamide
SMILESO=C(NCC(O)CO)c1ccc2[nH]c3ccccc3c2c1
InChIInChI=1S/C16H16N2O3/c19-9-11(20)8-17-16(21)10-5-6-15-13(7-10)12-3-1-2-4-14(12)18-15/h1-7,11,18-20H,8-9H2,(H,17,21)
InChIKeyKAVIWBYXGGXARC-UHFFFAOYSA-N
MW284.32 g/mol
LogP1.40
Rot. Bonds4

About N-(2,3-dihydroxypropyl)-9H-carbazole-3-carboxamide

N-(2,3-dihydroxypropyl)-9H-carbazole-3-carboxamide (PubChem CID 3148374) has the molecular formula C16H16N2O3 and a molecular weight of 284.32 g/mol. Its IUPAC name is N-(2,3-dihydroxypropyl)-9H-carbazole-3-carboxamide.

Molecular Properties

Compound NameN-(2,3-dihydroxypropyl)-9H-carbazole-3-carboxamide
PubChem CID3148374
Molecular FormulaC16H16N2O3
Molecular Weight284.32 g/mol
Exact Mass284.12
IUPAC NameN-(2,3-dihydroxypropyl)-9H-carbazole-3-carboxamide
SMILESO=C(NCC(O)CO)c1ccc2[nH]c3ccccc3c2c1
InChIInChI=1S/C16H16N2O3/c19-9-11(20)8-17-16(21)10-5-6-15-13(7-10)12-3-1-2-4-14(12)18-15/h1-7,11,18-20H,8-9H2,(H,17,21)
InChIKeyKAVIWBYXGGXARC-UHFFFAOYSA-N
XLogP1.40
TPSA85.35 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 51.40
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydroxypropyl)-9H-carbazole-3-carboxamide?
The IUPAC name of N-(2,3-dihydroxypropyl)-9H-carbazole-3-carboxamide (CID 3148374) is N-(2,3-dihydroxypropyl)-9H-carbazole-3-carboxamide.
What is the SMILES notation for N-(2,3-dihydroxypropyl)-9H-carbazole-3-carboxamide?
The canonical SMILES for N-(2,3-dihydroxypropyl)-9H-carbazole-3-carboxamide is O=C(NCC(O)CO)c1ccc2[nH]c3ccccc3c2c1.
What is the InChIKey of N-(2,3-dihydroxypropyl)-9H-carbazole-3-carboxamide?
The InChIKey is KAVIWBYXGGXARC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O3/c19-9-11(20)8-17-16(21)10-5-6-15-13(7-10)12-3-1-2-4-14(12)18-15/h1-7,11,18-20H,8-9H2,(H,17,21).
What are the key properties of N-(2,3-dihydroxypropyl)-9H-carbazole-3-carboxamide?
N-(2,3-dihydroxypropyl)-9H-carbazole-3-carboxamide has a molecular weight of 284.32 g/mol, XLogP of 1.40, 4 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydroxypropyl)-9H-carbazole-3-carboxamide is sourced from PubChem (CID 3148374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).