N-(furan-2-ylmethyl)-2-[[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]amino]propanamide

C20H24N2O3 — CID 51096389

IUPACN-(furan-2-ylmethyl)-2-[[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]amino]propanamide
SMILESCC(NC(=O)Cc1ccc2c(c1)CCCC2)C(=O)NCc1ccco1
InChIInChI=1S/C20H24N2O3/c1-14(20(24)21-13-18-7-4-10-25-18)22-19(23)12-15-8-9-16-5-2-3-6-17(16)11-15/h4,7-11,14H,2-3,5-6,12-13H2,1H3,(H,21,24)(H,22,23)
InChIKeyNYHLJFIZYXEWOK-UHFFFAOYSA-N
MW340.42 g/mol
LogP2.52
Rot. Bonds6

About N-(furan-2-ylmethyl)-2-[[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]amino]propanamide

N-(furan-2-ylmethyl)-2-[[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]amino]propanamide (PubChem CID 51096389) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2-[[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]amino]propanamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2-[[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]amino]propanamide
PubChem CID51096389
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC NameN-(furan-2-ylmethyl)-2-[[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]amino]propanamide
SMILESCC(NC(=O)Cc1ccc2c(c1)CCCC2)C(=O)NCc1ccco1
InChIInChI=1S/C20H24N2O3/c1-14(20(24)21-13-18-7-4-10-25-18)22-19(23)12-15-8-9-16-5-2-3-6-17(16)11-15/h4,7-11,14H,2-3,5-6,12-13H2,1H3,(H,21,24)(H,22,23)
InChIKeyNYHLJFIZYXEWOK-UHFFFAOYSA-N
XLogP2.52
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-N-(furan-2-ylmethyl)-2-[[2-(4-methoxyphenyl)acetyl]amino]propanamide
CID 110348304
N-(furan-2-ylmethyl)-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)butanamide
CID 133231084
N-propan-2-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
CID 60645733
2-(2,3-dihydro-1H-inden-5-yloxy)-N-(furan-2-ylmethyl)butanamide
CID 45148077
2-[[2-(2,3-dihydro-1H-inden-5-yl)acetyl]amino]propanoic acid
CID 43239418
2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-N-(furan-2-ylmethyl)-3-methylbutanamide
CID 112813149
2-(2,3-dihydro-1H-inden-5-yl)-N-propan-2-ylacetamide
CID 60645732
methyl 2-[[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]amino]propanoate
CID 60645922
[(2S)-1-(furan-2-ylmethylamino)-1-oxopropan-2-yl] 2-(2,3-dihydro-1H-inden-5-yloxy)acetate
CID 7234960
N-[(2R)-1-(furan-2-ylmethylamino)-1-oxopropan-2-yl]cyclohexanecarboxamide
CID 94216559
(2S)-N-(furan-2-ylmethyl)-2-[[2-(4-methylphenoxy)acetyl]amino]propanamide
CID 110348322
N-[(2S)-1-(furan-2-ylmethylamino)-1-oxopropan-2-yl]-3,5-dimethoxybenzamide
CID 110348293

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2-[[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]amino]propanamide?
The IUPAC name of N-(furan-2-ylmethyl)-2-[[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]amino]propanamide (CID 51096389) is N-(furan-2-ylmethyl)-2-[[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]amino]propanamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-2-[[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]amino]propanamide?
The canonical SMILES for N-(furan-2-ylmethyl)-2-[[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]amino]propanamide is CC(NC(=O)Cc1ccc2c(c1)CCCC2)C(=O)NCc1ccco1.
What is the InChIKey of N-(furan-2-ylmethyl)-2-[[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]amino]propanamide?
The InChIKey is NYHLJFIZYXEWOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3/c1-14(20(24)21-13-18-7-4-10-25-18)22-19(23)12-15-8-9-16-5-2-3-6-17(16)11-15/h4,7-11,14H,2-3,5-6,12-13H2,1H3,(H,21,24)(H,22,23).
What are the key properties of N-(furan-2-ylmethyl)-2-[[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]amino]propanamide?
N-(furan-2-ylmethyl)-2-[[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]amino]propanamide has a molecular weight of 340.42 g/mol, XLogP of 2.52, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-2-[[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]amino]propanamide is sourced from PubChem (CID 51096389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).