2-(cyclopropylamino)-4-(4-propan-2-ylphenoxy)butanamide

C16H24N2O2 — CID 63038784

IUPAC2-(cyclopropylamino)-4-(4-propan-2-ylphenoxy)butanamide
SMILESCC(C)c1ccc(OCCC(NC2CC2)C(N)=O)cc1
InChIInChI=1S/C16H24N2O2/c1-11(2)12-3-7-14(8-4-12)20-10-9-15(16(17)19)18-13-5-6-13/h3-4,7-8,11,13,15,18H,5-6,9-10H2,1-2H3,(H2,17,19)
InChIKeyXSCPOOXPBJUREK-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.18
Rot. Bonds8

About 2-(cyclopropylamino)-4-(4-propan-2-ylphenoxy)butanamide

2-(cyclopropylamino)-4-(4-propan-2-ylphenoxy)butanamide (PubChem CID 63038784) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 2-(cyclopropylamino)-4-(4-propan-2-ylphenoxy)butanamide.

Molecular Properties

Compound Name2-(cyclopropylamino)-4-(4-propan-2-ylphenoxy)butanamide
PubChem CID63038784
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name2-(cyclopropylamino)-4-(4-propan-2-ylphenoxy)butanamide
SMILESCC(C)c1ccc(OCCC(NC2CC2)C(N)=O)cc1
InChIInChI=1S/C16H24N2O2/c1-11(2)12-3-7-14(8-4-12)20-10-9-15(16(17)19)18-13-5-6-13/h3-4,7-8,11,13,15,18H,5-6,9-10H2,1-2H3,(H2,17,19)
InChIKeyXSCPOOXPBJUREK-UHFFFAOYSA-N
XLogP2.18
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(4-butan-2-ylphenoxy)-2-(cyclopropylamino)butanamide
CID 107667971
2-(cyclopropylamino)-4-(3,4-difluorophenoxy)butanamide
CID 63035661
2-(cyclopropylamino)-4-(3-fluorophenoxy)butanamide
CID 63039927
2-(methylamino)-4-(4-propan-2-ylphenoxy)butanoic acid
CID 63038968
2-(cyclopropylamino)-4-(2,3-dimethylphenoxy)butanamide
CID 63039159
2-(cyclopropylamino)-4-(2-fluoro-3-methylphenoxy)butanamide
CID 107660548
2-(cyclopentylamino)-2-(4-propoxyphenyl)acetamide
CID 62495956
2-(cyclopropylamino)-4-(2,3-difluorophenoxy)butanamide
CID 63038366
methyl 2-(cyclopropylamino)-4-(2,3-dihydro-1H-inden-5-yloxy)butanoate
CID 63039299
2-(cyclopropylamino)-2-(4-propan-2-yloxyphenyl)acetamide
CID 54937644
2-(ethylamino)-4-(4-propoxyphenoxy)butanamide
CID 63033885
2-(cyclohexylamino)-2-(4-ethoxyphenyl)acetamide
CID 60998636

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-4-(4-propan-2-ylphenoxy)butanamide?
The IUPAC name of 2-(cyclopropylamino)-4-(4-propan-2-ylphenoxy)butanamide (CID 63038784) is 2-(cyclopropylamino)-4-(4-propan-2-ylphenoxy)butanamide.
What is the SMILES notation for 2-(cyclopropylamino)-4-(4-propan-2-ylphenoxy)butanamide?
The canonical SMILES for 2-(cyclopropylamino)-4-(4-propan-2-ylphenoxy)butanamide is CC(C)c1ccc(OCCC(NC2CC2)C(N)=O)cc1.
What is the InChIKey of 2-(cyclopropylamino)-4-(4-propan-2-ylphenoxy)butanamide?
The InChIKey is XSCPOOXPBJUREK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-11(2)12-3-7-14(8-4-12)20-10-9-15(16(17)19)18-13-5-6-13/h3-4,7-8,11,13,15,18H,5-6,9-10H2,1-2H3,(H2,17,19).
What are the key properties of 2-(cyclopropylamino)-4-(4-propan-2-ylphenoxy)butanamide?
2-(cyclopropylamino)-4-(4-propan-2-ylphenoxy)butanamide has a molecular weight of 276.38 g/mol, XLogP of 2.18, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-4-(4-propan-2-ylphenoxy)butanamide is sourced from PubChem (CID 63038784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).