N-[1-(4-tert-butylphenyl)ethyl]-2-(ethylamino)-2-methylpropanamide

C18H30N2O — CID 62833570

IUPACN-[1-(4-tert-butylphenyl)ethyl]-2-(ethylamino)-2-methylpropanamide
SMILESCCNC(C)(C)C(=O)NC(C)c1ccc(C(C)(C)C)cc1
InChIInChI=1S/C18H30N2O/c1-8-19-18(6,7)16(21)20-13(2)14-9-11-15(12-10-14)17(3,4)5/h9-13,19H,8H2,1-7H3,(H,20,21)
InChIKeyZMXOACGKAMZOKG-UHFFFAOYSA-N
MW290.45 g/mol
LogP3.55
Rot. Bonds5

About N-[1-(4-tert-butylphenyl)ethyl]-2-(ethylamino)-2-methylpropanamide

N-[1-(4-tert-butylphenyl)ethyl]-2-(ethylamino)-2-methylpropanamide (PubChem CID 62833570) has the molecular formula C18H30N2O and a molecular weight of 290.45 g/mol. Its IUPAC name is N-[1-(4-tert-butylphenyl)ethyl]-2-(ethylamino)-2-methylpropanamide.

Molecular Properties

Compound NameN-[1-(4-tert-butylphenyl)ethyl]-2-(ethylamino)-2-methylpropanamide
PubChem CID62833570
Molecular FormulaC18H30N2O
Molecular Weight290.45 g/mol
Exact Mass290.24
IUPAC NameN-[1-(4-tert-butylphenyl)ethyl]-2-(ethylamino)-2-methylpropanamide
SMILESCCNC(C)(C)C(=O)NC(C)c1ccc(C(C)(C)C)cc1
InChIInChI=1S/C18H30N2O/c1-8-19-18(6,7)16(21)20-13(2)14-9-11-15(12-10-14)17(3,4)5/h9-13,19H,8H2,1-7H3,(H,20,21)
InChIKeyZMXOACGKAMZOKG-UHFFFAOYSA-N
XLogP3.55
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 53.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(4-ethoxyphenyl)ethyl]-2-(ethylamino)-2-methylpropanamide
CID 62836048
2-(ethylamino)-N-[1-(3-hydroxyphenyl)ethyl]-2-methylpropanamide
CID 55121666
2-bromo-N-[1-(4-tert-butylphenyl)ethyl]propanamide
CID 107903587
2-(ethylamino)-N-[(1R)-1-(furan-2-yl)ethyl]-2-methylpropanamide
CID 81400808
2-amino-N-[1-(4-tert-butylphenyl)ethyl]-2-cyclopropylpropanamide
CID 60866617
(2R)-2-[[2-(ethylamino)-2-methylpropanoyl]amino]-2-phenylacetic acid
CID 62836836
2-(ethylamino)-2-methyl-N-(3-methylbutan-2-yl)propanamide
CID 62833567
(2S)-2-amino-N-[1-(4-tert-butylphenyl)ethyl]-3-methylbutanamide
CID 61155319
(2R)-2-amino-N-[1-(4-tert-butylphenyl)ethyl]-3,3-dimethylbutanamide
CID 103928603
N-[1-(4-tert-butylphenyl)ethyl]-5-hydroxypentanamide
CID 79198933
2-(ethylamino)-2-methyl-N-[1-(4-methyl-1,2,4-triazol-3-yl)ethyl]propanamide
CID 62833078
N-[1-(4-tert-butylphenyl)ethyl]pyridine-4-carboxamide
CID 17173747

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-tert-butylphenyl)ethyl]-2-(ethylamino)-2-methylpropanamide?
The IUPAC name of N-[1-(4-tert-butylphenyl)ethyl]-2-(ethylamino)-2-methylpropanamide (CID 62833570) is N-[1-(4-tert-butylphenyl)ethyl]-2-(ethylamino)-2-methylpropanamide.
What is the SMILES notation for N-[1-(4-tert-butylphenyl)ethyl]-2-(ethylamino)-2-methylpropanamide?
The canonical SMILES for N-[1-(4-tert-butylphenyl)ethyl]-2-(ethylamino)-2-methylpropanamide is CCNC(C)(C)C(=O)NC(C)c1ccc(C(C)(C)C)cc1.
What is the InChIKey of N-[1-(4-tert-butylphenyl)ethyl]-2-(ethylamino)-2-methylpropanamide?
The InChIKey is ZMXOACGKAMZOKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2O/c1-8-19-18(6,7)16(21)20-13(2)14-9-11-15(12-10-14)17(3,4)5/h9-13,19H,8H2,1-7H3,(H,20,21).
What are the key properties of N-[1-(4-tert-butylphenyl)ethyl]-2-(ethylamino)-2-methylpropanamide?
N-[1-(4-tert-butylphenyl)ethyl]-2-(ethylamino)-2-methylpropanamide has a molecular weight of 290.45 g/mol, XLogP of 3.55, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-tert-butylphenyl)ethyl]-2-(ethylamino)-2-methylpropanamide is sourced from PubChem (CID 62833570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).