2-amino-N-[1-[4-(3-methylbutoxy)phenyl]ethyl]acetamide

C15H24N2O2 — CID 119311263

IUPAC2-amino-N-[1-[4-(3-methylbutoxy)phenyl]ethyl]acetamide
SMILESCC(C)CCOc1ccc(C(C)NC(=O)CN)cc1
InChIInChI=1S/C15H24N2O2/c1-11(2)8-9-19-14-6-4-13(5-7-14)12(3)17-15(18)10-16/h4-7,11-12H,8-10,16H2,1-3H3,(H,17,18)
InChIKeyQWLNMXZMGYWYCW-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.25
Rot. Bonds7

About 2-amino-N-[1-[4-(3-methylbutoxy)phenyl]ethyl]acetamide

2-amino-N-[1-[4-(3-methylbutoxy)phenyl]ethyl]acetamide (PubChem CID 119311263) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-amino-N-[1-[4-(3-methylbutoxy)phenyl]ethyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[1-[4-(3-methylbutoxy)phenyl]ethyl]acetamide
PubChem CID119311263
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name2-amino-N-[1-[4-(3-methylbutoxy)phenyl]ethyl]acetamide
SMILESCC(C)CCOc1ccc(C(C)NC(=O)CN)cc1
InChIInChI=1S/C15H24N2O2/c1-11(2)8-9-19-14-6-4-13(5-7-14)12(3)17-15(18)10-16/h4-7,11-12H,8-10,16H2,1-3H3,(H,17,18)
InChIKeyQWLNMXZMGYWYCW-UHFFFAOYSA-N
XLogP2.25
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-N-[1-[4-(3-methylbutoxy)phenyl]ethyl]propanamide
CID 119311259
2-[2-[[(1R)-1-[4-(3-methylbutoxy)phenyl]ethyl]amino]-2-oxoethyl]sulfanylacetamide
CID 95596907
2-amino-N-[(1R)-1-(4-methoxyphenyl)ethyl]acetamide
CID 81364080
2-amino-N-[1-[4-(3-methylbutoxy)phenyl]ethyl]pentanamide
CID 119311275
2-amino-N-(1-phenylethyl)acetamide
CID 10631169
2-[4-(3-methylbutoxy)phenoxy]-N-propan-2-ylacetamide
CID 4732908
3-(4-fluorophenoxy)-N-[1-(4-fluorophenyl)ethyl]propanamide
CID 43060182
N-[1-[4-(3-methylbutoxy)phenyl]ethyl]-2-thiomorpholin-3-ylacetamide
CID 119938284
4-amino-N-[1-[4-(2-methylpropoxy)phenyl]ethyl]pentanamide;hydrochloride
CID 120563845
2-amino-N-[2-oxo-2-[1-(4-propan-2-yloxyphenyl)ethylamino]ethyl]acetamide
CID 60846458
3-(4-ethylphenoxy)-N-[1-(4-ethylphenyl)ethyl]propanamide
CID 108795767
N-[1-[4-(3-methylbutoxy)phenyl]ethyl]-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide
CID 86877255

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[1-[4-(3-methylbutoxy)phenyl]ethyl]acetamide?
The IUPAC name of 2-amino-N-[1-[4-(3-methylbutoxy)phenyl]ethyl]acetamide (CID 119311263) is 2-amino-N-[1-[4-(3-methylbutoxy)phenyl]ethyl]acetamide.
What is the SMILES notation for 2-amino-N-[1-[4-(3-methylbutoxy)phenyl]ethyl]acetamide?
The canonical SMILES for 2-amino-N-[1-[4-(3-methylbutoxy)phenyl]ethyl]acetamide is CC(C)CCOc1ccc(C(C)NC(=O)CN)cc1.
What is the InChIKey of 2-amino-N-[1-[4-(3-methylbutoxy)phenyl]ethyl]acetamide?
The InChIKey is QWLNMXZMGYWYCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-11(2)8-9-19-14-6-4-13(5-7-14)12(3)17-15(18)10-16/h4-7,11-12H,8-10,16H2,1-3H3,(H,17,18).
What are the key properties of 2-amino-N-[1-[4-(3-methylbutoxy)phenyl]ethyl]acetamide?
2-amino-N-[1-[4-(3-methylbutoxy)phenyl]ethyl]acetamide has a molecular weight of 264.37 g/mol, XLogP of 2.25, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[1-[4-(3-methylbutoxy)phenyl]ethyl]acetamide is sourced from PubChem (CID 119311263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).