4-amino-N-(2-tert-butylphenyl)butanamide;hydrochloride

C14H23ClN2O — CID 119164498

IUPAC4-amino-N-(2-tert-butylphenyl)butanamide;hydrochloride
SMILESCC(C)(C)c1ccccc1NC(=O)CCCN.Cl
InChIInChI=1S/C14H22N2O.ClH/c1-14(2,3)11-7-4-5-8-12(11)16-13(17)9-6-10-15;/h4-5,7-8H,6,9-10,15H2,1-3H3,(H,16,17);1H
InChIKeyNKKVTAZZPRRGGM-UHFFFAOYSA-N
MW270.80 g/mol
LogP3.08
Rot. Bonds4

About 4-amino-N-(2-tert-butylphenyl)butanamide;hydrochloride

4-amino-N-(2-tert-butylphenyl)butanamide;hydrochloride (PubChem CID 119164498) has the molecular formula C14H23ClN2O and a molecular weight of 270.80 g/mol. Its IUPAC name is 4-amino-N-(2-tert-butylphenyl)butanamide;hydrochloride.

Molecular Properties

Compound Name4-amino-N-(2-tert-butylphenyl)butanamide;hydrochloride
PubChem CID119164498
Molecular FormulaC14H23ClN2O
Molecular Weight270.80 g/mol
Exact Mass270.15
IUPAC Name4-amino-N-(2-tert-butylphenyl)butanamide;hydrochloride
SMILESCC(C)(C)c1ccccc1NC(=O)CCCN.Cl
InChIInChI=1S/C14H22N2O.ClH/c1-14(2,3)11-7-4-5-8-12(11)16-13(17)9-6-10-15;/h4-5,7-8H,6,9-10,15H2,1-3H3,(H,16,17);1H
InChIKeyNKKVTAZZPRRGGM-UHFFFAOYSA-N
XLogP3.08
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.80
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 43697568
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CID 112517031
2-(4-aminobutanoylamino)-N-tert-butylbenzamide
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CID 28978404
7-amino-N-(2-methylphenyl)heptanamide;hydrochloride
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4-amino-N-(2-ethoxyphenyl)butanamide;hydrochloride
CID 119263924
N-(2-tert-butylphenyl)-3-(4-chlorophenyl)sulfanylpropanamide
CID 7920186
N-(2-tert-butylphenyl)-2-methylsulfanylacetamide
CID 67575618
4-amino-N-[2-(methanesulfonamido)phenyl]butanamide
CID 43710881
4-amino-N-[2-[2-(methylamino)-2-oxoethyl]phenyl]butanamide
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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2-tert-butylphenyl)butanamide;hydrochloride?
The IUPAC name of 4-amino-N-(2-tert-butylphenyl)butanamide;hydrochloride (CID 119164498) is 4-amino-N-(2-tert-butylphenyl)butanamide;hydrochloride.
What is the SMILES notation for 4-amino-N-(2-tert-butylphenyl)butanamide;hydrochloride?
The canonical SMILES for 4-amino-N-(2-tert-butylphenyl)butanamide;hydrochloride is CC(C)(C)c1ccccc1NC(=O)CCCN.Cl.
What is the InChIKey of 4-amino-N-(2-tert-butylphenyl)butanamide;hydrochloride?
The InChIKey is NKKVTAZZPRRGGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O.ClH/c1-14(2,3)11-7-4-5-8-12(11)16-13(17)9-6-10-15;/h4-5,7-8H,6,9-10,15H2,1-3H3,(H,16,17);1H.
What are the key properties of 4-amino-N-(2-tert-butylphenyl)butanamide;hydrochloride?
4-amino-N-(2-tert-butylphenyl)butanamide;hydrochloride has a molecular weight of 270.80 g/mol, XLogP of 3.08, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2-tert-butylphenyl)butanamide;hydrochloride is sourced from PubChem (CID 119164498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).