(2R)-2-amino-N-(2-formamido-5-methoxyphenyl)propanamide

C11H15N3O3 — CID 143527427

IUPAC(2R)-2-amino-N-(2-formamido-5-methoxyphenyl)propanamide
SMILESCOc1ccc(NC=O)c(NC(=O)[C@@H](C)N)c1
InChIInChI=1S/C11H15N3O3/c1-7(12)11(16)14-10-5-8(17-2)3-4-9(10)13-6-15/h3-7H,12H2,1-2H3,(H,13,15)(H,14,16)/t7-/m1/s1
InChIKeyNGKKAALFRPFQKC-SSDOTTSWSA-N
MW237.26 g/mol
LogP0.55
Rot. Bonds5

About (2R)-2-amino-N-(2-formamido-5-methoxyphenyl)propanamide

(2R)-2-amino-N-(2-formamido-5-methoxyphenyl)propanamide (PubChem CID 143527427) has the molecular formula C11H15N3O3 and a molecular weight of 237.26 g/mol. Its IUPAC name is (2R)-2-amino-N-(2-formamido-5-methoxyphenyl)propanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-(2-formamido-5-methoxyphenyl)propanamide
PubChem CID143527427
Molecular FormulaC11H15N3O3
Molecular Weight237.26 g/mol
Exact Mass237.11
IUPAC Name(2R)-2-amino-N-(2-formamido-5-methoxyphenyl)propanamide
SMILESCOc1ccc(NC=O)c(NC(=O)[C@@H](C)N)c1
InChIInChI=1S/C11H15N3O3/c1-7(12)11(16)14-10-5-8(17-2)3-4-9(10)13-6-15/h3-7H,12H2,1-2H3,(H,13,15)(H,14,16)/t7-/m1/s1
InChIKeyNGKKAALFRPFQKC-SSDOTTSWSA-N
XLogP0.55
TPSA93.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 50.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

(2R)-2-amino-N-(2-iodo-5-methoxyphenyl)propanamide
CID 119307887
2-amino-N-(2-iodo-5-methoxyphenyl)propanamide;hydrochloride
CID 119307884
(2S)-2-amino-N-(2-methyl-4-propan-2-yloxyphenyl)propanamide
CID 92930680
3-amino-N-(2-fluoro-5-methoxyphenyl)-2-methylbutanamide
CID 113416369
N-[2-(2-aminopropanoyl)-4-methoxyphenyl]acetamide
CID 105497647
(2S)-2-amino-N-(2-fluoro-4-propan-2-yloxyphenyl)propanamide
CID 119308643
(2S)-N-(2-amino-4-methoxyphenyl)-2-methylbutanamide
CID 40788880
2-amino-N-(2,5-dimethoxyphenyl)-3,3-dimethylbutanamide
CID 76892238
(2S)-2-amino-N-(2,4-dimethoxyphenyl)-3,3-dimethylbutanamide
CID 61148145
4-[[(2R)-2-aminopropanoyl]amino]-3-methoxybenzoic acid
CID 167188995
(2S)-2-amino-N-(2,4-dimethoxyphenyl)-4-methylpentanamide
CID 22691067
(2S)-2-amino-N-(2,4-dimethoxyphenyl)-3-methylpentanamide
CID 22690883

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-(2-formamido-5-methoxyphenyl)propanamide?
The IUPAC name of (2R)-2-amino-N-(2-formamido-5-methoxyphenyl)propanamide (CID 143527427) is (2R)-2-amino-N-(2-formamido-5-methoxyphenyl)propanamide.
What is the SMILES notation for (2R)-2-amino-N-(2-formamido-5-methoxyphenyl)propanamide?
The canonical SMILES for (2R)-2-amino-N-(2-formamido-5-methoxyphenyl)propanamide is COc1ccc(NC=O)c(NC(=O)[C@@H](C)N)c1.
What is the InChIKey of (2R)-2-amino-N-(2-formamido-5-methoxyphenyl)propanamide?
The InChIKey is NGKKAALFRPFQKC-SSDOTTSWSA-N. The full InChI is InChI=1S/C11H15N3O3/c1-7(12)11(16)14-10-5-8(17-2)3-4-9(10)13-6-15/h3-7H,12H2,1-2H3,(H,13,15)(H,14,16)/t7-/m1/s1.
What are the key properties of (2R)-2-amino-N-(2-formamido-5-methoxyphenyl)propanamide?
(2R)-2-amino-N-(2-formamido-5-methoxyphenyl)propanamide has a molecular weight of 237.26 g/mol, XLogP of 0.55, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-(2-formamido-5-methoxyphenyl)propanamide is sourced from PubChem (CID 143527427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).