1-[methyl(naphthalen-2-yl)amino]-3-(oxolan-2-ylmethoxy)propan-2-ol

C19H25NO3 — CID 78827395

IUPAC1-[methyl(naphthalen-2-yl)amino]-3-(oxolan-2-ylmethoxy)propan-2-ol
SMILESCN(CC(O)COCC1CCCO1)c1ccc2ccccc2c1
InChIInChI=1S/C19H25NO3/c1-20(12-18(21)13-22-14-19-7-4-10-23-19)17-9-8-15-5-2-3-6-16(15)11-17/h2-3,5-6,8-9,11,18-19,21H,4,7,10,12-14H2,1H3
InChIKeyFHYUDVRAXANIST-UHFFFAOYSA-N
MW315.41 g/mol
LogP2.83
Rot. Bonds7

About 1-[methyl(naphthalen-2-yl)amino]-3-(oxolan-2-ylmethoxy)propan-2-ol

1-[methyl(naphthalen-2-yl)amino]-3-(oxolan-2-ylmethoxy)propan-2-ol (PubChem CID 78827395) has the molecular formula C19H25NO3 and a molecular weight of 315.41 g/mol. Its IUPAC name is 1-[methyl(naphthalen-2-yl)amino]-3-(oxolan-2-ylmethoxy)propan-2-ol.

Molecular Properties

Compound Name1-[methyl(naphthalen-2-yl)amino]-3-(oxolan-2-ylmethoxy)propan-2-ol
PubChem CID78827395
Molecular FormulaC19H25NO3
Molecular Weight315.41 g/mol
Exact Mass315.18
IUPAC Name1-[methyl(naphthalen-2-yl)amino]-3-(oxolan-2-ylmethoxy)propan-2-ol
SMILESCN(CC(O)COCC1CCCO1)c1ccc2ccccc2c1
InChIInChI=1S/C19H25NO3/c1-20(12-18(21)13-22-14-19-7-4-10-23-19)17-9-8-15-5-2-3-6-16(15)11-17/h2-3,5-6,8-9,11,18-19,21H,4,7,10,12-14H2,1H3
InChIKeyFHYUDVRAXANIST-UHFFFAOYSA-N
XLogP2.83
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.41
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(oxolan-2-ylmethoxy)-3-(N,2,3-trimethylanilino)propan-2-ol
CID 110900484
1-(diethylamino)-3-(oxolan-2-ylmethoxy)propan-2-ol
CID 110877523
(2S)-1-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-3-[[(2R)-oxolan-2-yl]methoxy]propan-2-ol
CID 124737593
(2R)-1-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]-3-[[(2R)-oxolan-2-yl]methoxy]propan-2-ol
CID 124799203
1-[cyclopentyl(ethyl)amino]-3-(oxolan-2-ylmethoxy)propan-2-ol
CID 110892631
1-[2-[3-(dimethylamino)phenyl]pyrrolidin-1-yl]-3-(oxolan-2-ylmethoxy)propan-2-ol
CID 111488930
(2S)-1-[methyl(1,3-thiazol-4-ylmethyl)amino]-3-[[(2S)-oxolan-2-yl]methoxy]propan-2-ol
CID 95044295
1-[[(1R)-1-(2-methylphenyl)ethyl]amino]-3-(oxolan-2-ylmethoxy)propan-2-ol
CID 81364457
1-(2-bromoanilino)-3-(oxolan-2-ylmethoxy)propan-2-ol
CID 60896835
2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-[(2S)-2-hydroxy-3-[[(2R)-oxolan-2-yl]methoxy]propyl]azanium
CID 2093317
1-[cyclobutyl(methyl)amino]-3-naphthalen-2-yloxypropan-2-ol
CID 111488940
1-[(2-fluorophenyl)methylamino]-3-(oxolan-2-ylmethoxy)propan-2-ol
CID 60633304

Frequently Asked Questions

What is the IUPAC name of 1-[methyl(naphthalen-2-yl)amino]-3-(oxolan-2-ylmethoxy)propan-2-ol?
The IUPAC name of 1-[methyl(naphthalen-2-yl)amino]-3-(oxolan-2-ylmethoxy)propan-2-ol (CID 78827395) is 1-[methyl(naphthalen-2-yl)amino]-3-(oxolan-2-ylmethoxy)propan-2-ol.
What is the SMILES notation for 1-[methyl(naphthalen-2-yl)amino]-3-(oxolan-2-ylmethoxy)propan-2-ol?
The canonical SMILES for 1-[methyl(naphthalen-2-yl)amino]-3-(oxolan-2-ylmethoxy)propan-2-ol is CN(CC(O)COCC1CCCO1)c1ccc2ccccc2c1.
What is the InChIKey of 1-[methyl(naphthalen-2-yl)amino]-3-(oxolan-2-ylmethoxy)propan-2-ol?
The InChIKey is FHYUDVRAXANIST-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO3/c1-20(12-18(21)13-22-14-19-7-4-10-23-19)17-9-8-15-5-2-3-6-16(15)11-17/h2-3,5-6,8-9,11,18-19,21H,4,7,10,12-14H2,1H3.
What are the key properties of 1-[methyl(naphthalen-2-yl)amino]-3-(oxolan-2-ylmethoxy)propan-2-ol?
1-[methyl(naphthalen-2-yl)amino]-3-(oxolan-2-ylmethoxy)propan-2-ol has a molecular weight of 315.41 g/mol, XLogP of 2.83, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[methyl(naphthalen-2-yl)amino]-3-(oxolan-2-ylmethoxy)propan-2-ol is sourced from PubChem (CID 78827395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).