2-amino-N-ethyl-3-methoxy-N-naphthalen-1-ylpropanamide

C16H20N2O2 — CID 81082117

IUPAC2-amino-N-ethyl-3-methoxy-N-naphthalen-1-ylpropanamide
SMILESCCN(C(=O)C(N)COC)c1cccc2ccccc12
InChIInChI=1S/C16H20N2O2/c1-3-18(16(19)14(17)11-20-2)15-10-6-8-12-7-4-5-9-13(12)15/h4-10,14H,3,11,17H2,1-2H3
InChIKeyCMOFTVLOIDRZEH-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.17
Rot. Bonds5

About 2-amino-N-ethyl-3-methoxy-N-naphthalen-1-ylpropanamide

2-amino-N-ethyl-3-methoxy-N-naphthalen-1-ylpropanamide (PubChem CID 81082117) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is 2-amino-N-ethyl-3-methoxy-N-naphthalen-1-ylpropanamide.

Molecular Properties

Compound Name2-amino-N-ethyl-3-methoxy-N-naphthalen-1-ylpropanamide
PubChem CID81082117
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC Name2-amino-N-ethyl-3-methoxy-N-naphthalen-1-ylpropanamide
SMILESCCN(C(=O)C(N)COC)c1cccc2ccccc12
InChIInChI=1S/C16H20N2O2/c1-3-18(16(19)14(17)11-20-2)15-10-6-8-12-7-4-5-9-13(12)15/h4-10,14H,3,11,17H2,1-2H3
InChIKeyCMOFTVLOIDRZEH-UHFFFAOYSA-N
XLogP2.17
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-amino-N-ethyl-3-methyl-N-naphthalen-1-ylbutanamide
CID 79011768
(2R)-2-chloro-N-ethyl-N-naphthalen-1-ylpropanamide
CID 2529538
2-amino-N-ethyl-4-methoxy-N-(2-methylphenyl)butanamide
CID 62472432
(2R)-N-ethyl-N-naphthalen-1-yl-2-propan-2-ylsulfonylpropanamide
CID 95625088
4-amino-N-ethyl-3-methoxy-N-naphthalen-1-ylbutanamide
CID 103154156
2-amino-N-ethyl-2-methyl-N-naphthalen-1-ylpropanamide
CID 61265760
methyl 1-[(2S)-1-[ethyl(naphthalen-1-yl)amino]-1-oxopropan-2-yl]piperidin-1-ium-4-carboxylate
CID 8741731
ethyl 2-[2-[ethyl(naphthalen-1-yl)amino]-2-oxoethyl]sulfanylacetate
CID 78760483
methyl N-methoxycarbonyl-N-naphthalen-1-ylcarbamate
CID 138084079
[2-[ethyl(naphthalen-1-yl)amino]-2-oxoethyl] 3-(4-methoxyphenoxy)propanoate
CID 29142245
propyl N-methyl-N-naphthalen-1-ylcarbamate
CID 71338053
2-(2-ethoxyphenoxy)-N-ethyl-N-naphthalen-1-ylacetamide
CID 112779417

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-ethyl-3-methoxy-N-naphthalen-1-ylpropanamide?
The IUPAC name of 2-amino-N-ethyl-3-methoxy-N-naphthalen-1-ylpropanamide (CID 81082117) is 2-amino-N-ethyl-3-methoxy-N-naphthalen-1-ylpropanamide.
What is the SMILES notation for 2-amino-N-ethyl-3-methoxy-N-naphthalen-1-ylpropanamide?
The canonical SMILES for 2-amino-N-ethyl-3-methoxy-N-naphthalen-1-ylpropanamide is CCN(C(=O)C(N)COC)c1cccc2ccccc12.
What is the InChIKey of 2-amino-N-ethyl-3-methoxy-N-naphthalen-1-ylpropanamide?
The InChIKey is CMOFTVLOIDRZEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-3-18(16(19)14(17)11-20-2)15-10-6-8-12-7-4-5-9-13(12)15/h4-10,14H,3,11,17H2,1-2H3.
What are the key properties of 2-amino-N-ethyl-3-methoxy-N-naphthalen-1-ylpropanamide?
2-amino-N-ethyl-3-methoxy-N-naphthalen-1-ylpropanamide has a molecular weight of 272.35 g/mol, XLogP of 2.17, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-ethyl-3-methoxy-N-naphthalen-1-ylpropanamide is sourced from PubChem (CID 81082117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).