(2R)-N-carbamoyl-2-(2-propan-2-ylphenoxy)propanamide

C13H18N2O3 — CID 95358323

IUPAC(2R)-N-carbamoyl-2-(2-propan-2-ylphenoxy)propanamide
SMILESCC(C)c1ccccc1O[C@H](C)C(=O)NC(N)=O
InChIInChI=1S/C13H18N2O3/c1-8(2)10-6-4-5-7-11(10)18-9(3)12(16)15-13(14)17/h4-9H,1-3H3,(H3,14,15,16,17)/t9-/m1/s1
InChIKeyFCRXUBPDNGZVPJ-SECBINFHSA-N
MW250.30 g/mol
LogP1.77
Rot. Bonds4

About (2R)-N-carbamoyl-2-(2-propan-2-ylphenoxy)propanamide

(2R)-N-carbamoyl-2-(2-propan-2-ylphenoxy)propanamide (PubChem CID 95358323) has the molecular formula C13H18N2O3 and a molecular weight of 250.30 g/mol. Its IUPAC name is (2R)-N-carbamoyl-2-(2-propan-2-ylphenoxy)propanamide.

Molecular Properties

Compound Name(2R)-N-carbamoyl-2-(2-propan-2-ylphenoxy)propanamide
PubChem CID95358323
Molecular FormulaC13H18N2O3
Molecular Weight250.30 g/mol
Exact Mass250.13
IUPAC Name(2R)-N-carbamoyl-2-(2-propan-2-ylphenoxy)propanamide
SMILESCC(C)c1ccccc1O[C@H](C)C(=O)NC(N)=O
InChIInChI=1S/C13H18N2O3/c1-8(2)10-6-4-5-7-11(10)18-9(3)12(16)15-13(14)17/h4-9H,1-3H3,(H3,14,15,16,17)/t9-/m1/s1
InChIKeyFCRXUBPDNGZVPJ-SECBINFHSA-N
XLogP1.77
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-N-carbamoyl-2-(2-fluorophenoxy)propanamide
CID 7815239
(2S)-2-(2-propan-2-ylphenoxy)-N-(2-propan-2-ylphenyl)propanamide
CID 28636194
(2R)-2-(2-propan-2-ylphenoxy)-N-(2-propan-2-ylphenyl)propanamide
CID 28636193
(2R)-N-ethyl-2-(2-propan-2-ylphenoxy)propanamide
CID 92685149
N-(4-propan-2-yloxyphenyl)-2-(2-propan-2-ylphenoxy)propanamide
CID 43907362
N-carbamoyl-2-[2-[(2-methylpropylamino)methyl]phenoxy]propanamide
CID 63062222
N-(3-propan-2-yloxypropyl)-2-(2-propan-2-ylphenoxy)propanamide
CID 43877163
(2S)-N-(2-methyl-6-propan-2-ylphenyl)-2-(2-propan-2-ylphenoxy)propanamide
CID 38017144
N-cycloheptyl-2-(2-propan-2-ylphenoxy)propanamide
CID 43904274
(2S)-N-[2-(dimethylamino)ethyl]-2-(2-propan-2-ylphenoxy)propanamide
CID 30379413
(2R)-N-[(3-propan-2-yloxyphenyl)methyl]-2-(2-propan-2-ylphenoxy)propanamide
CID 92683578
2-[2-[(1R)-1-aminoethyl]-4-bromophenoxy]-N-carbamoylpropanamide
CID 78937100

Frequently Asked Questions

What is the IUPAC name of (2R)-N-carbamoyl-2-(2-propan-2-ylphenoxy)propanamide?
The IUPAC name of (2R)-N-carbamoyl-2-(2-propan-2-ylphenoxy)propanamide (CID 95358323) is (2R)-N-carbamoyl-2-(2-propan-2-ylphenoxy)propanamide.
What is the SMILES notation for (2R)-N-carbamoyl-2-(2-propan-2-ylphenoxy)propanamide?
The canonical SMILES for (2R)-N-carbamoyl-2-(2-propan-2-ylphenoxy)propanamide is CC(C)c1ccccc1O[C@H](C)C(=O)NC(N)=O.
What is the InChIKey of (2R)-N-carbamoyl-2-(2-propan-2-ylphenoxy)propanamide?
The InChIKey is FCRXUBPDNGZVPJ-SECBINFHSA-N. The full InChI is InChI=1S/C13H18N2O3/c1-8(2)10-6-4-5-7-11(10)18-9(3)12(16)15-13(14)17/h4-9H,1-3H3,(H3,14,15,16,17)/t9-/m1/s1.
What are the key properties of (2R)-N-carbamoyl-2-(2-propan-2-ylphenoxy)propanamide?
(2R)-N-carbamoyl-2-(2-propan-2-ylphenoxy)propanamide has a molecular weight of 250.30 g/mol, XLogP of 1.77, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-carbamoyl-2-(2-propan-2-ylphenoxy)propanamide is sourced from PubChem (CID 95358323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).