N-tert-butyl-2-[[1-(methylamino)-2,3-dihydro-1H-inden-4-yl]oxy]propanamide

C17H26N2O2 — CID 63089776

IUPACN-tert-butyl-2-[[1-(methylamino)-2,3-dihydro-1H-inden-4-yl]oxy]propanamide
SMILESCNC1CCc2c(OC(C)C(=O)NC(C)(C)C)cccc21
InChIInChI=1S/C17H26N2O2/c1-11(16(20)19-17(2,3)4)21-15-8-6-7-12-13(15)9-10-14(12)18-5/h6-8,11,14,18H,9-10H2,1-5H3,(H,19,20)
InChIKeyFPOYSHMXUALZGE-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.58
Rot. Bonds4

About N-tert-butyl-2-[[1-(methylamino)-2,3-dihydro-1H-inden-4-yl]oxy]propanamide

N-tert-butyl-2-[[1-(methylamino)-2,3-dihydro-1H-inden-4-yl]oxy]propanamide (PubChem CID 63089776) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-tert-butyl-2-[[1-(methylamino)-2,3-dihydro-1H-inden-4-yl]oxy]propanamide.

Molecular Properties

Compound NameN-tert-butyl-2-[[1-(methylamino)-2,3-dihydro-1H-inden-4-yl]oxy]propanamide
PubChem CID63089776
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN-tert-butyl-2-[[1-(methylamino)-2,3-dihydro-1H-inden-4-yl]oxy]propanamide
SMILESCNC1CCc2c(OC(C)C(=O)NC(C)(C)C)cccc21
InChIInChI=1S/C17H26N2O2/c1-11(16(20)19-17(2,3)4)21-15-8-6-7-12-13(15)9-10-14(12)18-5/h6-8,11,14,18H,9-10H2,1-5H3,(H,19,20)
InChIKeyFPOYSHMXUALZGE-UHFFFAOYSA-N
XLogP2.58
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 2-[[1-(methylamino)-2,3-dihydro-1H-inden-4-yl]oxy]propanoate
CID 63091357
2-[[1-(methylamino)-2,3-dihydro-1H-inden-4-yl]oxy]-N-(2-methylpropyl)propanamide
CID 63089777
2-[[1-(methylamino)-2,3-dihydro-1H-inden-4-yl]oxy]-N-prop-2-ynylpropanamide
CID 63090825
2-[(1-hydroxy-2,3-dihydro-1H-inden-4-yl)oxy]-N-propan-2-ylpropanamide
CID 55179521
2-[(1-amino-2,3-dihydro-1H-inden-4-yl)oxy]-N-cyclopropylpropanamide
CID 63090463
2-[(5-hydroxy-5,6,7,8-tetrahydronaphthalen-1-yl)oxy]-N-methylpropanamide
CID 60665655
2-[[1-(ethylamino)-2,3-dihydro-1H-inden-4-yl]oxy]-N,N-dimethylpropanamide
CID 63091735
(2S)-2-amino-N-(4-methoxy-2,3-dihydro-1H-inden-1-yl)propanamide
CID 119317459
2-methyl-4-[[1-(methylamino)-2,3-dihydro-1H-inden-4-yl]oxy]butan-2-ol
CID 79360871
4-(2-methoxyethoxy)-N-methyl-2,3-dihydro-1H-inden-1-amine
CID 63090830
2-[2-[1-(tert-butylamino)-1-oxopropan-2-yl]oxyphenyl]acetic acid
CID 80741308
N-(4-methoxy-2,3-dihydro-1H-inden-1-yl)-4,4-dimethyl-2-(methylamino)pentanamide
CID 166235164

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-[[1-(methylamino)-2,3-dihydro-1H-inden-4-yl]oxy]propanamide?
The IUPAC name of N-tert-butyl-2-[[1-(methylamino)-2,3-dihydro-1H-inden-4-yl]oxy]propanamide (CID 63089776) is N-tert-butyl-2-[[1-(methylamino)-2,3-dihydro-1H-inden-4-yl]oxy]propanamide.
What is the SMILES notation for N-tert-butyl-2-[[1-(methylamino)-2,3-dihydro-1H-inden-4-yl]oxy]propanamide?
The canonical SMILES for N-tert-butyl-2-[[1-(methylamino)-2,3-dihydro-1H-inden-4-yl]oxy]propanamide is CNC1CCc2c(OC(C)C(=O)NC(C)(C)C)cccc21.
What is the InChIKey of N-tert-butyl-2-[[1-(methylamino)-2,3-dihydro-1H-inden-4-yl]oxy]propanamide?
The InChIKey is FPOYSHMXUALZGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-11(16(20)19-17(2,3)4)21-15-8-6-7-12-13(15)9-10-14(12)18-5/h6-8,11,14,18H,9-10H2,1-5H3,(H,19,20).
What are the key properties of N-tert-butyl-2-[[1-(methylamino)-2,3-dihydro-1H-inden-4-yl]oxy]propanamide?
N-tert-butyl-2-[[1-(methylamino)-2,3-dihydro-1H-inden-4-yl]oxy]propanamide has a molecular weight of 290.41 g/mol, XLogP of 2.58, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-[[1-(methylamino)-2,3-dihydro-1H-inden-4-yl]oxy]propanamide is sourced from PubChem (CID 63089776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).