N-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-2-methoxy-2-(oxan-4-yl)acetamide

C19H27NO3 — CID 166305023

IUPACN-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-2-methoxy-2-(oxan-4-yl)acetamide
SMILESCOC(C(=O)NCCC1Cc2ccccc2C1)C1CCOCC1
InChIInChI=1S/C19H27NO3/c1-22-18(15-7-10-23-11-8-15)19(21)20-9-6-14-12-16-4-2-3-5-17(16)13-14/h2-5,14-15,18H,6-13H2,1H3,(H,20,21)
InChIKeyMNEKNGBRWGUJPN-UHFFFAOYSA-N
MW317.43 g/mol
LogP2.35
Rot. Bonds6

About N-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-2-methoxy-2-(oxan-4-yl)acetamide

N-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-2-methoxy-2-(oxan-4-yl)acetamide (PubChem CID 166305023) has the molecular formula C19H27NO3 and a molecular weight of 317.43 g/mol. Its IUPAC name is N-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-2-methoxy-2-(oxan-4-yl)acetamide.

Molecular Properties

Compound NameN-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-2-methoxy-2-(oxan-4-yl)acetamide
PubChem CID166305023
Molecular FormulaC19H27NO3
Molecular Weight317.43 g/mol
Exact Mass317.20
IUPAC NameN-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-2-methoxy-2-(oxan-4-yl)acetamide
SMILESCOC(C(=O)NCCC1Cc2ccccc2C1)C1CCOCC1
InChIInChI=1S/C19H27NO3/c1-22-18(15-7-10-23-11-8-15)19(21)20-9-6-14-12-16-4-2-3-5-17(16)13-14/h2-5,14-15,18H,6-13H2,1H3,(H,20,21)
InChIKeyMNEKNGBRWGUJPN-UHFFFAOYSA-N
XLogP2.35
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.43
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[2-(oxan-4-yl)ethyl]-2-phenylacetamide;hydrochloride
CID 119290193
1-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-3-[(2-ethylphenyl)methyl]urea
CID 166381064
(2S)-2-amino-N-[2-(oxan-4-yl)ethyl]-3-phenylpropanamide
CID 119290183
1-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-3-[(2S)-1-[(S)-methylsulfinyl]propan-2-yl]urea
CID 97351085
1-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-3-[(2S)-1-[(R)-methylsulfinyl]propan-2-yl]urea
CID 97351087
2-amino-N-(2-cyclohexylethyl)-2-(oxan-4-yl)acetamide;hydrochloride
CID 120787635
(2R)-N-[(3S)-3-hydroxy-3-(oxan-4-yl)propyl]-2-phenoxypropanamide
CID 99996598
2-amino-N-[2-(4-methoxyphenyl)ethyl]-2-(oxan-4-yl)acetamide;hydrochloride
CID 120782919
2-amino-N-(3,3-diphenylpropyl)-2-(oxan-4-yl)acetamide;hydrochloride
CID 120783183
2-amino-N-[2-(2,6-dichlorophenyl)ethyl]-2-(oxan-4-yl)acetamide;hydrochloride
CID 120789587
methyl 2-anilino-2-(oxan-4-yl)acetate
CID 62386905
N-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]propan-2-amine
CID 115906594

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-2-methoxy-2-(oxan-4-yl)acetamide?
The IUPAC name of N-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-2-methoxy-2-(oxan-4-yl)acetamide (CID 166305023) is N-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-2-methoxy-2-(oxan-4-yl)acetamide.
What is the SMILES notation for N-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-2-methoxy-2-(oxan-4-yl)acetamide?
The canonical SMILES for N-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-2-methoxy-2-(oxan-4-yl)acetamide is COC(C(=O)NCCC1Cc2ccccc2C1)C1CCOCC1.
What is the InChIKey of N-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-2-methoxy-2-(oxan-4-yl)acetamide?
The InChIKey is MNEKNGBRWGUJPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27NO3/c1-22-18(15-7-10-23-11-8-15)19(21)20-9-6-14-12-16-4-2-3-5-17(16)13-14/h2-5,14-15,18H,6-13H2,1H3,(H,20,21).
What are the key properties of N-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-2-methoxy-2-(oxan-4-yl)acetamide?
N-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-2-methoxy-2-(oxan-4-yl)acetamide has a molecular weight of 317.43 g/mol, XLogP of 2.35, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-2-methoxy-2-(oxan-4-yl)acetamide is sourced from PubChem (CID 166305023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).