2-(6-chloro-9H-carbazol-2-yl)-N-methylpropanamide

C16H15ClN2O — CID 71482982

IUPAC2-(6-chloro-9H-carbazol-2-yl)-N-methylpropanamide
SMILESCNC(=O)C(C)c1ccc2c(c1)[nH]c1ccc(Cl)cc12
InChIInChI=1S/C16H15ClN2O/c1-9(16(20)18-2)10-3-5-12-13-8-11(17)4-6-14(13)19-15(12)7-10/h3-9,19H,1-2H3,(H,18,20)
InChIKeyINEDAINSGYELMG-UHFFFAOYSA-N
MW286.76 g/mol
LogP3.82
Rot. Bonds2

About 2-(6-chloro-9H-carbazol-2-yl)-N-methylpropanamide

2-(6-chloro-9H-carbazol-2-yl)-N-methylpropanamide (PubChem CID 71482982) has the molecular formula C16H15ClN2O and a molecular weight of 286.76 g/mol. Its IUPAC name is 2-(6-chloro-9H-carbazol-2-yl)-N-methylpropanamide.

Molecular Properties

Compound Name2-(6-chloro-9H-carbazol-2-yl)-N-methylpropanamide
PubChem CID71482982
Molecular FormulaC16H15ClN2O
Molecular Weight286.76 g/mol
Exact Mass286.09
IUPAC Name2-(6-chloro-9H-carbazol-2-yl)-N-methylpropanamide
SMILESCNC(=O)C(C)c1ccc2c(c1)[nH]c1ccc(Cl)cc12
InChIInChI=1S/C16H15ClN2O/c1-9(16(20)18-2)10-3-5-12-13-8-11(17)4-6-14(13)19-15(12)7-10/h3-9,19H,1-2H3,(H,18,20)
InChIKeyINEDAINSGYELMG-UHFFFAOYSA-N
XLogP3.82
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.76
LogP ≤ 53.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

(2S)-2-(6-chloro-9H-carbazol-2-yl)-N-(4-methylphenyl)propanamide
CID 41010161
(2S)-2-(6-chloro-9H-carbazol-2-yl)-N-cyclopropylpropanamide
CID 41062678
(2S)-2-(6-chloro-9H-carbazol-2-yl)propanamide
CID 71483149
(2S)-2-(6-chloro-9H-carbazol-2-yl)propanoate
CID 6919166
(2R)-2-(6-chloro-9H-carbazol-2-yl)-N-[(2R)-2,3-dihydroxypropyl]propanamide
CID 41087768
(2S)-2-(6-chloro-9H-carbazol-2-yl)-N-(1H-1,2,4-triazol-5-yl)propanamide
CID 97266964
2-(6-chloro-9H-carbazol-2-yl)-N-(2-hydroxy-1-phenylethyl)propanamide
CID 71710526
(2R)-2-(6-chloro-9H-carbazol-2-yl)-N-[(1S)-2-hydroxy-1-phenylethyl]propanamide
CID 40918719
(2R)-2-(6-chloro-9H-carbazol-2-yl)-N-(1,3-thiazol-2-yl)propanamide
CID 41062772
(2S)-2-(6-chloro-9H-carbazol-2-yl)-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]propanamide
CID 40918404
(2R)-2-(6-chloro-9H-carbazol-2-yl)propanoic acid;(2S)-2-(6-chloro-9H-carbazol-2-yl)propanoic acid;tris(4-pyridin-4-ylpyridine)
CID 139196134
ethyl 4-[[(2R)-2-(6-chloro-9H-carbazol-2-yl)propanoyl]amino]piperidine-1-carboxylate
CID 41118330

Frequently Asked Questions

What is the IUPAC name of 2-(6-chloro-9H-carbazol-2-yl)-N-methylpropanamide?
The IUPAC name of 2-(6-chloro-9H-carbazol-2-yl)-N-methylpropanamide (CID 71482982) is 2-(6-chloro-9H-carbazol-2-yl)-N-methylpropanamide.
What is the SMILES notation for 2-(6-chloro-9H-carbazol-2-yl)-N-methylpropanamide?
The canonical SMILES for 2-(6-chloro-9H-carbazol-2-yl)-N-methylpropanamide is CNC(=O)C(C)c1ccc2c(c1)[nH]c1ccc(Cl)cc12.
What is the InChIKey of 2-(6-chloro-9H-carbazol-2-yl)-N-methylpropanamide?
The InChIKey is INEDAINSGYELMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClN2O/c1-9(16(20)18-2)10-3-5-12-13-8-11(17)4-6-14(13)19-15(12)7-10/h3-9,19H,1-2H3,(H,18,20).
What are the key properties of 2-(6-chloro-9H-carbazol-2-yl)-N-methylpropanamide?
2-(6-chloro-9H-carbazol-2-yl)-N-methylpropanamide has a molecular weight of 286.76 g/mol, XLogP of 3.82, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-chloro-9H-carbazol-2-yl)-N-methylpropanamide is sourced from PubChem (CID 71482982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).