2-[4-(1-cyclopropylpropylamino)phenoxy]acetamide

C14H20N2O2 — CID 64918188

IUPAC2-[4-(1-cyclopropylpropylamino)phenoxy]acetamide
SMILESCCC(Nc1ccc(OCC(N)=O)cc1)C1CC1
InChIInChI=1S/C14H20N2O2/c1-2-13(10-3-4-10)16-11-5-7-12(8-6-11)18-9-14(15)17/h5-8,10,13,16H,2-4,9H2,1H3,(H2,15,17)
InChIKeyCHXRUCHAQRYRGD-UHFFFAOYSA-N
MW248.33 g/mol
LogP2.15
Rot. Bonds7

About 2-[4-(1-cyclopropylpropylamino)phenoxy]acetamide

2-[4-(1-cyclopropylpropylamino)phenoxy]acetamide (PubChem CID 64918188) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 2-[4-(1-cyclopropylpropylamino)phenoxy]acetamide.

Molecular Properties

Compound Name2-[4-(1-cyclopropylpropylamino)phenoxy]acetamide
PubChem CID64918188
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name2-[4-(1-cyclopropylpropylamino)phenoxy]acetamide
SMILESCCC(Nc1ccc(OCC(N)=O)cc1)C1CC1
InChIInChI=1S/C14H20N2O2/c1-2-13(10-3-4-10)16-11-5-7-12(8-6-11)18-9-14(15)17/h5-8,10,13,16H,2-4,9H2,1H3,(H2,15,17)
InChIKeyCHXRUCHAQRYRGD-UHFFFAOYSA-N
XLogP2.15
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

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Related Compounds

2-[4-(propan-2-ylamino)phenoxy]acetamide
CID 43711183
2-[4-[(4-propan-2-ylcyclohexyl)amino]phenoxy]acetamide
CID 62708775
methyl 4-(1-cyclopropylpropylamino)benzoate
CID 64917542
N-[4-(1-cyclopropylpropylamino)phenyl]-2-methoxyacetamide
CID 64920329
2-[4-[(3-propan-2-ylcyclobutyl)amino]phenoxy]acetamide
CID 103561296
4-(1-cyclopropylpropylamino)-N,N-dimethylbenzamide
CID 64919471
2-[4-(thian-4-ylamino)phenoxy]acetamide
CID 43711231
(2S)-2-amino-N-[4-(2-amino-2-oxoethoxy)phenyl]butanamide;hydrochloride
CID 119281571
5-(1-cyclopropylpropylamino)-2-fluorobenzamide
CID 64917346
2-[4-(1-piperidin-2-ylpropan-2-ylamino)phenoxy]acetamide
CID 79538614
2-[4-(1-pyridin-2-ylethylamino)phenoxy]acetamide
CID 43711075
2-(1-cyclopropylpropylamino)oxyacetamide
CID 112672608

Frequently Asked Questions

What is the IUPAC name of 2-[4-(1-cyclopropylpropylamino)phenoxy]acetamide?
The IUPAC name of 2-[4-(1-cyclopropylpropylamino)phenoxy]acetamide (CID 64918188) is 2-[4-(1-cyclopropylpropylamino)phenoxy]acetamide.
What is the SMILES notation for 2-[4-(1-cyclopropylpropylamino)phenoxy]acetamide?
The canonical SMILES for 2-[4-(1-cyclopropylpropylamino)phenoxy]acetamide is CCC(Nc1ccc(OCC(N)=O)cc1)C1CC1.
What is the InChIKey of 2-[4-(1-cyclopropylpropylamino)phenoxy]acetamide?
The InChIKey is CHXRUCHAQRYRGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-2-13(10-3-4-10)16-11-5-7-12(8-6-11)18-9-14(15)17/h5-8,10,13,16H,2-4,9H2,1H3,(H2,15,17).
What are the key properties of 2-[4-(1-cyclopropylpropylamino)phenoxy]acetamide?
2-[4-(1-cyclopropylpropylamino)phenoxy]acetamide has a molecular weight of 248.33 g/mol, XLogP of 2.15, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(1-cyclopropylpropylamino)phenoxy]acetamide is sourced from PubChem (CID 64918188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).