N-(2-amino-2-ethylbutyl)naphthalene-2-carboxamide

C17H22N2O — CID 81485257

IUPACN-(2-amino-2-ethylbutyl)naphthalene-2-carboxamide
SMILESCCC(N)(CC)CNC(=O)c1ccc2ccccc2c1
InChIInChI=1S/C17H22N2O/c1-3-17(18,4-2)12-19-16(20)15-10-9-13-7-5-6-8-14(13)11-15/h5-11H,3-4,12,18H2,1-2H3,(H,19,20)
InChIKeyWLGAJELSCDSWON-UHFFFAOYSA-N
MW270.38 g/mol
LogP3.09
Rot. Bonds5

About N-(2-amino-2-ethylbutyl)naphthalene-2-carboxamide

N-(2-amino-2-ethylbutyl)naphthalene-2-carboxamide (PubChem CID 81485257) has the molecular formula C17H22N2O and a molecular weight of 270.38 g/mol. Its IUPAC name is N-(2-amino-2-ethylbutyl)naphthalene-2-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-ethylbutyl)naphthalene-2-carboxamide
PubChem CID81485257
Molecular FormulaC17H22N2O
Molecular Weight270.38 g/mol
Exact Mass270.17
IUPAC NameN-(2-amino-2-ethylbutyl)naphthalene-2-carboxamide
SMILESCCC(N)(CC)CNC(=O)c1ccc2ccccc2c1
InChIInChI=1S/C17H22N2O/c1-3-17(18,4-2)12-19-16(20)15-10-9-13-7-5-6-8-14(13)11-15/h5-11H,3-4,12,18H2,1-2H3,(H,19,20)
InChIKeyWLGAJELSCDSWON-UHFFFAOYSA-N
XLogP3.09
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-ethyl-2-(hydroxymethyl)butyl]naphthalene-2-carboxamide
CID 103843738
ethyl 2-(naphthalene-2-carbonylamino)acetate
CID 43007593
N-(2-amino-2-ethylbutyl)-3,4-dimethylbenzamide
CID 81484563
N-propylnaphthalene-2-carboxamide
CID 6624536
N-(2-amino-2-ethylbutyl)-1,3-dihydro-2-benzofuran-5-carboxamide
CID 81484647
N-(2-amino-2-ethylbutyl)-2-naphthalen-2-yloxyacetamide
CID 119639639
ethane;naphthalene-2-carbohydrazide
CID 91601372
N-pentylnaphthalene-2-carboxamide
CID 91722098
N-(2-amino-2-ethylbutyl)-4-(dimethylamino)benzamide
CID 115305742
N-[4-(naphthalene-2-carbonylamino)butyl]naphthalene-2-carboxamide
CID 101181857
N-(2-amino-2-ethylbutyl)-3-(carbamoylamino)benzamide;hydrochloride
CID 119640724
N-(2-amino-2-ethylbutyl)pyridine-4-carboxamide
CID 81482515

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-ethylbutyl)naphthalene-2-carboxamide?
The IUPAC name of N-(2-amino-2-ethylbutyl)naphthalene-2-carboxamide (CID 81485257) is N-(2-amino-2-ethylbutyl)naphthalene-2-carboxamide.
What is the SMILES notation for N-(2-amino-2-ethylbutyl)naphthalene-2-carboxamide?
The canonical SMILES for N-(2-amino-2-ethylbutyl)naphthalene-2-carboxamide is CCC(N)(CC)CNC(=O)c1ccc2ccccc2c1.
What is the InChIKey of N-(2-amino-2-ethylbutyl)naphthalene-2-carboxamide?
The InChIKey is WLGAJELSCDSWON-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O/c1-3-17(18,4-2)12-19-16(20)15-10-9-13-7-5-6-8-14(13)11-15/h5-11H,3-4,12,18H2,1-2H3,(H,19,20).
What are the key properties of N-(2-amino-2-ethylbutyl)naphthalene-2-carboxamide?
N-(2-amino-2-ethylbutyl)naphthalene-2-carboxamide has a molecular weight of 270.38 g/mol, XLogP of 3.09, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-ethylbutyl)naphthalene-2-carboxamide is sourced from PubChem (CID 81485257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).