N,2,2-trimethyl-3-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylamino]propanamide

C18H28N2O — CID 103917282

IUPACN,2,2-trimethyl-3-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylamino]propanamide
SMILESCNC(=O)C(C)(C)CNC(C)c1ccc2c(c1)CCCC2
InChIInChI=1S/C18H28N2O/c1-13(20-12-18(2,3)17(21)19-4)15-10-9-14-7-5-6-8-16(14)11-15/h9-11,13,20H,5-8,12H2,1-4H3,(H,19,21)
InChIKeyNJVZOTKZUZBXQZ-UHFFFAOYSA-N
MW288.44 g/mol
LogP2.99
Rot. Bonds5

About N,2,2-trimethyl-3-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylamino]propanamide

N,2,2-trimethyl-3-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylamino]propanamide (PubChem CID 103917282) has the molecular formula C18H28N2O and a molecular weight of 288.44 g/mol. Its IUPAC name is N,2,2-trimethyl-3-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylamino]propanamide.

Molecular Properties

Compound NameN,2,2-trimethyl-3-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylamino]propanamide
PubChem CID103917282
Molecular FormulaC18H28N2O
Molecular Weight288.44 g/mol
Exact Mass288.22
IUPAC NameN,2,2-trimethyl-3-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylamino]propanamide
SMILESCNC(=O)C(C)(C)CNC(C)c1ccc2c(c1)CCCC2
InChIInChI=1S/C18H28N2O/c1-13(20-12-18(2,3)17(21)19-4)15-10-9-14-7-5-6-8-16(14)11-15/h9-11,13,20H,5-8,12H2,1-4H3,(H,19,21)
InChIKeyNJVZOTKZUZBXQZ-UHFFFAOYSA-N
XLogP2.99
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,2-dimethyl-3-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylamino]propanamide
CID 103917195
ethyl 2-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylamino]acetate
CID 54917644
N-[(1R)-1-(2,3-dihydro-1H-inden-5-yl)ethyl]-2,2-dimethylpropanamide
CID 94487783
N-[1-(2,3-dihydro-1H-inden-5-yl)ethyl]-2,2-dimethylpropanamide
CID 133185989
4-methoxy-2-methyl-1-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylamino]butan-2-ol
CID 103784307
N,N-dimethyl-2-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylamino]acetamide
CID 43214735
2-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylamino]ethanol
CID 43151079
N-[1-[1-(2,3-dihydro-1H-inden-5-yl)ethylamino]-2-methylpropan-2-yl]methanesulfonamide
CID 63858734
2-methyl-2-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylamino]propanamide
CID 61220351
3-methyl-1-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylamino]butan-2-ol
CID 115720493
2,3-dimethyl-N-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]butan-1-amine
CID 64568274
3-[1-(2,3-dihydro-1H-inden-5-yl)ethylamino]-2-hydroxypropanamide
CID 114153528

Frequently Asked Questions

What is the IUPAC name of N,2,2-trimethyl-3-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylamino]propanamide?
The IUPAC name of N,2,2-trimethyl-3-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylamino]propanamide (CID 103917282) is N,2,2-trimethyl-3-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylamino]propanamide.
What is the SMILES notation for N,2,2-trimethyl-3-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylamino]propanamide?
The canonical SMILES for N,2,2-trimethyl-3-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylamino]propanamide is CNC(=O)C(C)(C)CNC(C)c1ccc2c(c1)CCCC2.
What is the InChIKey of N,2,2-trimethyl-3-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylamino]propanamide?
The InChIKey is NJVZOTKZUZBXQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O/c1-13(20-12-18(2,3)17(21)19-4)15-10-9-14-7-5-6-8-16(14)11-15/h9-11,13,20H,5-8,12H2,1-4H3,(H,19,21).
What are the key properties of N,2,2-trimethyl-3-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylamino]propanamide?
N,2,2-trimethyl-3-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylamino]propanamide has a molecular weight of 288.44 g/mol, XLogP of 2.99, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,2-trimethyl-3-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylamino]propanamide is sourced from PubChem (CID 103917282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).