1-methyl-2-(naphthalen-2-yloxymethyl)-5-propan-2-ylpyrrole

C19H21NO — CID 140976592

IUPAC1-methyl-2-(naphthalen-2-yloxymethyl)-5-propan-2-ylpyrrole
SMILESCC(C)c1ccc(COc2ccc3ccccc3c2)n1C
InChIInChI=1S/C19H21NO/c1-14(2)19-11-9-17(20(19)3)13-21-18-10-8-15-6-4-5-7-16(15)12-18/h4-12,14H,13H2,1-3H3
InChIKeyUSMFTYZBRYDBDG-UHFFFAOYSA-N
MW279.38 g/mol
LogP4.88
Rot. Bonds4

About 1-methyl-2-(naphthalen-2-yloxymethyl)-5-propan-2-ylpyrrole

1-methyl-2-(naphthalen-2-yloxymethyl)-5-propan-2-ylpyrrole (PubChem CID 140976592) has the molecular formula C19H21NO and a molecular weight of 279.38 g/mol. Its IUPAC name is 1-methyl-2-(naphthalen-2-yloxymethyl)-5-propan-2-ylpyrrole.

Molecular Properties

Compound Name1-methyl-2-(naphthalen-2-yloxymethyl)-5-propan-2-ylpyrrole
PubChem CID140976592
Molecular FormulaC19H21NO
Molecular Weight279.38 g/mol
Exact Mass279.16
IUPAC Name1-methyl-2-(naphthalen-2-yloxymethyl)-5-propan-2-ylpyrrole
SMILESCC(C)c1ccc(COc2ccc3ccccc3c2)n1C
InChIInChI=1S/C19H21NO/c1-14(2)19-11-9-17(20(19)3)13-21-18-10-8-15-6-4-5-7-16(15)12-18/h4-12,14H,13H2,1-3H3
InChIKeyUSMFTYZBRYDBDG-UHFFFAOYSA-N
XLogP4.88
TPSA14.16 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 54.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-methyl-4-[7-[(1-methyl-5-propan-2-ylpyrrol-2-yl)methoxy]naphthalen-1-yl]piperazine
CID 70193466
1-naphthalen-2-yloxypropan-2-ol
CID 2793897
2-ethoxynaphthalene
CID 118978197
2-(2-methoxypropoxy)naphthalene
CID 155439775
N,N-dimethyl-1-naphthalen-2-yloxypropan-2-amine
CID 4189894
1-ethyl-2-(naphthalen-2-yloxymethyl)pyrrolo[3,2-b]quinoxaline
CID 134812988
2-methyl-7-phenylmethoxynaphthalene
CID 90146760
2-amino-4-methyl-6-(naphthalen-2-yloxymethyl)pyrimidine-5-carboxylic acid
CID 54851615
ethoxyethane;2-ethoxynaphthalene
CID 118982387
2-[2-(4-methoxyphenoxy)propoxy]naphthalene
CID 86155874
CID 58761521
CID 58761521
N,2-dimethyl-3-naphthalen-2-yloxypropan-1-amine
CID 62459950

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-(naphthalen-2-yloxymethyl)-5-propan-2-ylpyrrole?
The IUPAC name of 1-methyl-2-(naphthalen-2-yloxymethyl)-5-propan-2-ylpyrrole (CID 140976592) is 1-methyl-2-(naphthalen-2-yloxymethyl)-5-propan-2-ylpyrrole.
What is the SMILES notation for 1-methyl-2-(naphthalen-2-yloxymethyl)-5-propan-2-ylpyrrole?
The canonical SMILES for 1-methyl-2-(naphthalen-2-yloxymethyl)-5-propan-2-ylpyrrole is CC(C)c1ccc(COc2ccc3ccccc3c2)n1C.
What is the InChIKey of 1-methyl-2-(naphthalen-2-yloxymethyl)-5-propan-2-ylpyrrole?
The InChIKey is USMFTYZBRYDBDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO/c1-14(2)19-11-9-17(20(19)3)13-21-18-10-8-15-6-4-5-7-16(15)12-18/h4-12,14H,13H2,1-3H3.
What are the key properties of 1-methyl-2-(naphthalen-2-yloxymethyl)-5-propan-2-ylpyrrole?
1-methyl-2-(naphthalen-2-yloxymethyl)-5-propan-2-ylpyrrole has a molecular weight of 279.38 g/mol, XLogP of 4.88, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-(naphthalen-2-yloxymethyl)-5-propan-2-ylpyrrole is sourced from PubChem (CID 140976592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).