1-(3-methoxycarbazol-9-yl)pentan-1-one

C18H19NO2 — CID 153297253

IUPAC1-(3-methoxycarbazol-9-yl)pentan-1-one
SMILESCCCCC(=O)n1c2ccccc2c2cc(OC)ccc21
InChIInChI=1S/C18H19NO2/c1-3-4-9-18(20)19-16-8-6-5-7-14(16)15-12-13(21-2)10-11-17(15)19/h5-8,10-12H,3-4,9H2,1-2H3
InChIKeyROLGIOINITVNRL-UHFFFAOYSA-N
MW281.36 g/mol
LogP4.63
Rot. Bonds4

About 1-(3-methoxycarbazol-9-yl)pentan-1-one

1-(3-methoxycarbazol-9-yl)pentan-1-one (PubChem CID 153297253) has the molecular formula C18H19NO2 and a molecular weight of 281.36 g/mol. Its IUPAC name is 1-(3-methoxycarbazol-9-yl)pentan-1-one.

Molecular Properties

Compound Name1-(3-methoxycarbazol-9-yl)pentan-1-one
PubChem CID153297253
Molecular FormulaC18H19NO2
Molecular Weight281.36 g/mol
Exact Mass281.14
IUPAC Name1-(3-methoxycarbazol-9-yl)pentan-1-one
SMILESCCCCC(=O)n1c2ccccc2c2cc(OC)ccc21
InChIInChI=1S/C18H19NO2/c1-3-4-9-18(20)19-16-8-6-5-7-14(16)15-12-13(21-2)10-11-17(15)19/h5-8,10-12H,3-4,9H2,1-2H3
InChIKeyROLGIOINITVNRL-UHFFFAOYSA-N
XLogP4.63
TPSA31.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 54.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

9-butyl-3-methoxycarbazole
CID 132503458
5-(3-methoxycarbazol-9-yl)pentan-1-ol
CID 153297193
5-bromo-1-carbazol-9-ylpentan-1-one
CID 122483241
ethyl 6-(2-methoxy-9-oxoacridin-10-yl)hexanoate
CID 66663531
2-(2-methoxycarbazol-9-yl)-2-propylhexanamide
CID 91573517
3-methoxy-9-(trifluoromethyl)carbazole
CID 153297232
3-(3-methoxycarbazol-9-yl)propan-1-amine
CID 153297207
1-carbazol-9-yl-2-[(2E)-2-[(4-methoxyphenyl)methylidene]hydrazinyl]ethanone
CID 24864633
(4-methoxyphenyl)-(3-methylcarbazol-9-yl)methanone
CID 71534571
1-(9-phenylcarbazol-3-yl)pentan-1-one
CID 140927753
2-[1-(4-butoxybenzoyl)-5-methoxy-2-methylindol-3-yl]acetic acid
CID 11395329
N-[3-(3-methoxyphenyl)-1-methyl-4-oxoquinolin-2-yl]pentanamide
CID 4870056

Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxycarbazol-9-yl)pentan-1-one?
The IUPAC name of 1-(3-methoxycarbazol-9-yl)pentan-1-one (CID 153297253) is 1-(3-methoxycarbazol-9-yl)pentan-1-one.
What is the SMILES notation for 1-(3-methoxycarbazol-9-yl)pentan-1-one?
The canonical SMILES for 1-(3-methoxycarbazol-9-yl)pentan-1-one is CCCCC(=O)n1c2ccccc2c2cc(OC)ccc21.
What is the InChIKey of 1-(3-methoxycarbazol-9-yl)pentan-1-one?
The InChIKey is ROLGIOINITVNRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO2/c1-3-4-9-18(20)19-16-8-6-5-7-14(16)15-12-13(21-2)10-11-17(15)19/h5-8,10-12H,3-4,9H2,1-2H3.
What are the key properties of 1-(3-methoxycarbazol-9-yl)pentan-1-one?
1-(3-methoxycarbazol-9-yl)pentan-1-one has a molecular weight of 281.36 g/mol, XLogP of 4.63, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxycarbazol-9-yl)pentan-1-one is sourced from PubChem (CID 153297253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).