2-amino-3-(4-hydroxyphenyl)-N-(1-methylcyclobutyl)propanamide

C14H20N2O2 — CID 114350759

IUPAC2-amino-3-(4-hydroxyphenyl)-N-(1-methylcyclobutyl)propanamide
SMILESCC1(NC(=O)C(N)Cc2ccc(O)cc2)CCC1
InChIInChI=1S/C14H20N2O2/c1-14(7-2-8-14)16-13(18)12(15)9-10-3-5-11(17)6-4-10/h3-6,12,17H,2,7-9,15H2,1H3,(H,16,18)
InChIKeyCPFOIRDKRYEEFC-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.32
Rot. Bonds4

About 2-amino-3-(4-hydroxyphenyl)-N-(1-methylcyclobutyl)propanamide

2-amino-3-(4-hydroxyphenyl)-N-(1-methylcyclobutyl)propanamide (PubChem CID 114350759) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 2-amino-3-(4-hydroxyphenyl)-N-(1-methylcyclobutyl)propanamide.

Molecular Properties

Compound Name2-amino-3-(4-hydroxyphenyl)-N-(1-methylcyclobutyl)propanamide
PubChem CID114350759
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name2-amino-3-(4-hydroxyphenyl)-N-(1-methylcyclobutyl)propanamide
SMILESCC1(NC(=O)C(N)Cc2ccc(O)cc2)CCC1
InChIInChI=1S/C14H20N2O2/c1-14(7-2-8-14)16-13(18)12(15)9-10-3-5-11(17)6-4-10/h3-6,12,17H,2,7-9,15H2,1H3,(H,16,18)
InChIKeyCPFOIRDKRYEEFC-UHFFFAOYSA-N
XLogP1.32
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-3-(3,4-dihydroxyphenyl)-N-(1-methylcyclopentyl)propanamide
CID 61369463
2-amino-N-[1-(hydroxymethyl)cyclopropyl]-3-(4-hydroxyphenyl)propanamide
CID 114350792
(2S)-2-amino-N-(1-methylcyclohexyl)-3-pyridin-4-ylpropanamide
CID 138006096
1-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]cyclopentane-1-carboxylic acid
CID 76894205
2-amino-N-(3,3-dimethylcyclohexyl)-3-(4-hydroxyphenyl)propanamide
CID 114350623
2-amino-N-[(1-hydroxycyclopentyl)methyl]-3-(4-hydroxyphenyl)propanamide
CID 77056076
(2S)-2-amino-N-formyl-3-(4-hydroxyphenyl)propanamide
CID 88879957
(2S)-2-amino-N-(1-cyclobutylethyl)-3-(4-hydroxyphenyl)propanamide
CID 104871348
(2S)-2-amino-N-(2-hydroxyethyl)-3-(4-hydroxyphenyl)propanamide
CID 61155006
2-amino-N-cycloheptyl-3-(4-hydroxyphenyl)propanamide
CID 76892756
(2S)-2-amino-N-cyclohexyl-3-(4-hydroxyphenyl)propanamide
CID 61148836
(2R)-2-amino-N-(2,3-dimethylbutyl)-3-(4-hydroxyphenyl)propanamide
CID 104905233

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-(4-hydroxyphenyl)-N-(1-methylcyclobutyl)propanamide?
The IUPAC name of 2-amino-3-(4-hydroxyphenyl)-N-(1-methylcyclobutyl)propanamide (CID 114350759) is 2-amino-3-(4-hydroxyphenyl)-N-(1-methylcyclobutyl)propanamide.
What is the SMILES notation for 2-amino-3-(4-hydroxyphenyl)-N-(1-methylcyclobutyl)propanamide?
The canonical SMILES for 2-amino-3-(4-hydroxyphenyl)-N-(1-methylcyclobutyl)propanamide is CC1(NC(=O)C(N)Cc2ccc(O)cc2)CCC1.
What is the InChIKey of 2-amino-3-(4-hydroxyphenyl)-N-(1-methylcyclobutyl)propanamide?
The InChIKey is CPFOIRDKRYEEFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-14(7-2-8-14)16-13(18)12(15)9-10-3-5-11(17)6-4-10/h3-6,12,17H,2,7-9,15H2,1H3,(H,16,18).
What are the key properties of 2-amino-3-(4-hydroxyphenyl)-N-(1-methylcyclobutyl)propanamide?
2-amino-3-(4-hydroxyphenyl)-N-(1-methylcyclobutyl)propanamide has a molecular weight of 248.33 g/mol, XLogP of 1.32, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-(4-hydroxyphenyl)-N-(1-methylcyclobutyl)propanamide is sourced from PubChem (CID 114350759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).