N,N-dimethyl-4-[2-(oxolan-2-ylmethoxy)naphthalen-1-yl]benzamide

C24H25NO3 — CID 175640506

IUPACN,N-dimethyl-4-[2-(oxolan-2-ylmethoxy)naphthalen-1-yl]benzamide
SMILESCN(C)C(=O)c1ccc(-c2c(OCC3CCCO3)ccc3ccccc23)cc1
InChIInChI=1S/C24H25NO3/c1-25(2)24(26)19-11-9-18(10-12-19)23-21-8-4-3-6-17(21)13-14-22(23)28-16-20-7-5-15-27-20/h3-4,6,8-14,20H,5,7,15-16H2,1-2H3
InChIKeyRDRSJNMEWHXMDQ-UHFFFAOYSA-N
MW375.47 g/mol
LogP4.77
Rot. Bonds5

About N,N-dimethyl-4-[2-(oxolan-2-ylmethoxy)naphthalen-1-yl]benzamide

N,N-dimethyl-4-[2-(oxolan-2-ylmethoxy)naphthalen-1-yl]benzamide (PubChem CID 175640506) has the molecular formula C24H25NO3 and a molecular weight of 375.47 g/mol. Its IUPAC name is N,N-dimethyl-4-[2-(oxolan-2-ylmethoxy)naphthalen-1-yl]benzamide.

Molecular Properties

Compound NameN,N-dimethyl-4-[2-(oxolan-2-ylmethoxy)naphthalen-1-yl]benzamide
PubChem CID175640506
Molecular FormulaC24H25NO3
Molecular Weight375.47 g/mol
Exact Mass375.18
IUPAC NameN,N-dimethyl-4-[2-(oxolan-2-ylmethoxy)naphthalen-1-yl]benzamide
SMILESCN(C)C(=O)c1ccc(-c2c(OCC3CCCO3)ccc3ccccc23)cc1
InChIInChI=1S/C24H25NO3/c1-25(2)24(26)19-11-9-18(10-12-19)23-21-8-4-3-6-17(21)13-14-22(23)28-16-20-7-5-15-27-20/h3-4,6,8-14,20H,5,7,15-16H2,1-2H3
InChIKeyRDRSJNMEWHXMDQ-UHFFFAOYSA-N
XLogP4.77
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.47
LogP ≤ 54.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-[2-(oxan-2-ylmethoxy)naphthalen-1-yl]benzamide
CID 172666445
2-[4-[2-(oxolan-2-ylmethoxy)naphthalen-1-yl]phenyl]ethanamine;hydrochloride
CID 172910530
N,N-dimethyl-6-(oxolan-2-ylmethoxy)pyridine-3-carboxamide
CID 121017281
4-[[ethyl-[4-(oxolan-2-ylmethoxy)benzoyl]amino]methyl]-N,N-dimethylbenzamide
CID 56512059
2-[[1-[2-(oxiran-2-ylmethoxy)naphthalen-1-yl]naphthalen-2-yl]oxymethyl]oxirane
CID 86159181
1-(oxolan-2-yl)-N-[[2-(oxolan-2-ylmethoxy)naphthalen-1-yl]methyl]methanamine
CID 54847849
N-[[2-(oxolan-2-ylmethoxy)naphthalen-1-yl]methyl]propan-1-amine
CID 54804932
[2-[[(2S)-oxolan-2-yl]methoxy]phenyl]methanol
CID 28562688
2-[2-(oxan-2-ylmethoxy)naphthalen-1-yl]ethanamine
CID 60905678
2-[2-(oxolan-2-ylmethoxy)naphthalen-1-yl]-3-(oxolan-2-ylmethyl)-1,2-dihydroquinazolin-4-one
CID 54779717
4-methyl-N-[2-[[(2S)-oxolan-2-yl]methoxy]phenyl]benzamide
CID 41386200
2-[[2-(oxolan-2-ylmethoxy)naphthalen-1-yl]methylamino]butan-1-ol
CID 54849479

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-[2-(oxolan-2-ylmethoxy)naphthalen-1-yl]benzamide?
The IUPAC name of N,N-dimethyl-4-[2-(oxolan-2-ylmethoxy)naphthalen-1-yl]benzamide (CID 175640506) is N,N-dimethyl-4-[2-(oxolan-2-ylmethoxy)naphthalen-1-yl]benzamide.
What is the SMILES notation for N,N-dimethyl-4-[2-(oxolan-2-ylmethoxy)naphthalen-1-yl]benzamide?
The canonical SMILES for N,N-dimethyl-4-[2-(oxolan-2-ylmethoxy)naphthalen-1-yl]benzamide is CN(C)C(=O)c1ccc(-c2c(OCC3CCCO3)ccc3ccccc23)cc1.
What is the InChIKey of N,N-dimethyl-4-[2-(oxolan-2-ylmethoxy)naphthalen-1-yl]benzamide?
The InChIKey is RDRSJNMEWHXMDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25NO3/c1-25(2)24(26)19-11-9-18(10-12-19)23-21-8-4-3-6-17(21)13-14-22(23)28-16-20-7-5-15-27-20/h3-4,6,8-14,20H,5,7,15-16H2,1-2H3.
What are the key properties of N,N-dimethyl-4-[2-(oxolan-2-ylmethoxy)naphthalen-1-yl]benzamide?
N,N-dimethyl-4-[2-(oxolan-2-ylmethoxy)naphthalen-1-yl]benzamide has a molecular weight of 375.47 g/mol, XLogP of 4.77, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-[2-(oxolan-2-ylmethoxy)naphthalen-1-yl]benzamide is sourced from PubChem (CID 175640506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).