3-methoxy-9,10-dihydrophenanthrene-9-carboxamide

C16H15NO2 — CID 154254625

IUPAC3-methoxy-9,10-dihydrophenanthrene-9-carboxamide
SMILESCOc1ccc2c(c1)-c1ccccc1C(C(N)=O)C2
InChIInChI=1S/C16H15NO2/c1-19-11-7-6-10-8-15(16(17)18)13-5-3-2-4-12(13)14(10)9-11/h2-7,9,15H,8H2,1H3,(H2,17,18)
InChIKeySBPPHIDMOVFEKB-UHFFFAOYSA-N
MW253.30 g/mol
LogP2.49
Rot. Bonds2

About 3-methoxy-9,10-dihydrophenanthrene-9-carboxamide

3-methoxy-9,10-dihydrophenanthrene-9-carboxamide (PubChem CID 154254625) has the molecular formula C16H15NO2 and a molecular weight of 253.30 g/mol. Its IUPAC name is 3-methoxy-9,10-dihydrophenanthrene-9-carboxamide.

Molecular Properties

Compound Name3-methoxy-9,10-dihydrophenanthrene-9-carboxamide
PubChem CID154254625
Molecular FormulaC16H15NO2
Molecular Weight253.30 g/mol
Exact Mass253.11
IUPAC Name3-methoxy-9,10-dihydrophenanthrene-9-carboxamide
SMILESCOc1ccc2c(c1)-c1ccccc1C(C(N)=O)C2
InChIInChI=1S/C16H15NO2/c1-19-11-7-6-10-8-15(16(17)18)13-5-3-2-4-12(13)14(10)9-11/h2-7,9,15H,8H2,1H3,(H2,17,18)
InChIKeySBPPHIDMOVFEKB-UHFFFAOYSA-N
XLogP2.49
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.30
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,3-dimethoxy-9,10-dihydrophenanthrene-9-carboxylic acid
CID 70535600
methyl 5-methoxy-3-oxo-1,2-dihydroindene-2-carboxylate
CID 16639026
1-[(9R)-9,10-dihydrophenanthren-9-yl]ethanone
CID 102253511
(7S)-4-methoxybicyclo[4.2.0]octa-1(6),2,4-triene-7-carboxylate
CID 7055849
2-(9H-fluoren-9-ylmethoxycarbonyl)-6-methoxy-3,4-dihydro-1H-isoquinoline-4-carboxylic acid
CID 52982914
2,3-dimethoxy-9,10-dihydrophenanthren-9-amine
CID 70537938
ethyl 2-methoxy-5,6-dihydrophenanthridine-6-carboxylate
CID 132522989
2-benzoyl-7-methoxy-3,4-dihydro-2H-naphthalen-1-one
CID 79235413
5-methoxy-N-methyl-3-oxo-1,2-dihydroindene-1-carboxamide
CID 82158652
3-methoxy-10-(trifluoromethyl)-9,10-dihydrophenanthrene
CID 156693022
2-acetyl-5-methoxy-2,3-dihydroinden-1-one
CID 121012834
9-bromo-6-methoxytricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaen-2-one
CID 10032005

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-9,10-dihydrophenanthrene-9-carboxamide?
The IUPAC name of 3-methoxy-9,10-dihydrophenanthrene-9-carboxamide (CID 154254625) is 3-methoxy-9,10-dihydrophenanthrene-9-carboxamide.
What is the SMILES notation for 3-methoxy-9,10-dihydrophenanthrene-9-carboxamide?
The canonical SMILES for 3-methoxy-9,10-dihydrophenanthrene-9-carboxamide is COc1ccc2c(c1)-c1ccccc1C(C(N)=O)C2.
What is the InChIKey of 3-methoxy-9,10-dihydrophenanthrene-9-carboxamide?
The InChIKey is SBPPHIDMOVFEKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO2/c1-19-11-7-6-10-8-15(16(17)18)13-5-3-2-4-12(13)14(10)9-11/h2-7,9,15H,8H2,1H3,(H2,17,18).
What are the key properties of 3-methoxy-9,10-dihydrophenanthrene-9-carboxamide?
3-methoxy-9,10-dihydrophenanthrene-9-carboxamide has a molecular weight of 253.30 g/mol, XLogP of 2.49, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-9,10-dihydrophenanthrene-9-carboxamide is sourced from PubChem (CID 154254625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).