(2R)-2-amino-N-(3-ethenoxypropyl)propanamide

C8H16N2O2 — CID 78973332

IUPAC(2R)-2-amino-N-(3-ethenoxypropyl)propanamide
SMILESC=COCCCNC(=O)[C@@H](C)N
InChIInChI=1S/C8H16N2O2/c1-3-12-6-4-5-10-8(11)7(2)9/h3,7H,1,4-6,9H2,2H3,(H,10,11)/t7-/m1/s1
InChIKeyIAUNDEZNEDIEMK-SSDOTTSWSA-N
MW172.23 g/mol
LogP-0.00
Rot. Bonds6

About (2R)-2-amino-N-(3-ethenoxypropyl)propanamide

(2R)-2-amino-N-(3-ethenoxypropyl)propanamide (PubChem CID 78973332) has the molecular formula C8H16N2O2 and a molecular weight of 172.23 g/mol. Its IUPAC name is (2R)-2-amino-N-(3-ethenoxypropyl)propanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-(3-ethenoxypropyl)propanamide
PubChem CID78973332
Molecular FormulaC8H16N2O2
Molecular Weight172.23 g/mol
Exact Mass172.12
IUPAC Name(2R)-2-amino-N-(3-ethenoxypropyl)propanamide
SMILESC=COCCCNC(=O)[C@@H](C)N
InChIInChI=1S/C8H16N2O2/c1-3-12-6-4-5-10-8(11)7(2)9/h3,7H,1,4-6,9H2,2H3,(H,10,11)/t7-/m1/s1
InChIKeyIAUNDEZNEDIEMK-SSDOTTSWSA-N
XLogP-0.00
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 5-0.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-chloro-N-(3-ethenoxypropyl)-2-methylpropanamide
CID 62726850
1-(3-ethenoxypropyl)-3-propan-2-ylurea
CID 59741503
2-amino-N-(2-methoxyethyl)propanamide
CID 24703832
5-(3-ethenoxypropylamino)-3-methyl-5-oxopentanoic acid
CID 62964547
N-(3-ethenoxypropyl)-2-(methylamino)acetamide
CID 61274455
(2S)-2-amino-N-butyl(113C)propanamide
CID 157365112
(2S)-2-amino-N-butylpropan(15N)amide
CID 158456310
(2R)-2-amino-N-(2-but-3-enoxyethyl)propanamide
CID 106398122
1-amino-N-(3-ethenoxypropyl)cyclopropane-1-carboxamide
CID 65465567
2,2,2-trichloro-N-(3-ethenoxypropyl)acetamide
CID 87995485
(2S)-2-amino-N-[2-[[(2S)-2-aminopropanoyl]amino]ethyl]propanamide;dihydrochloride
CID 18651575
(2R)-2-amino-N-(4-hydroxybutyl)propanamide
CID 106842086

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-(3-ethenoxypropyl)propanamide?
The IUPAC name of (2R)-2-amino-N-(3-ethenoxypropyl)propanamide (CID 78973332) is (2R)-2-amino-N-(3-ethenoxypropyl)propanamide.
What is the SMILES notation for (2R)-2-amino-N-(3-ethenoxypropyl)propanamide?
The canonical SMILES for (2R)-2-amino-N-(3-ethenoxypropyl)propanamide is C=COCCCNC(=O)[C@@H](C)N.
What is the InChIKey of (2R)-2-amino-N-(3-ethenoxypropyl)propanamide?
The InChIKey is IAUNDEZNEDIEMK-SSDOTTSWSA-N. The full InChI is InChI=1S/C8H16N2O2/c1-3-12-6-4-5-10-8(11)7(2)9/h3,7H,1,4-6,9H2,2H3,(H,10,11)/t7-/m1/s1.
What are the key properties of (2R)-2-amino-N-(3-ethenoxypropyl)propanamide?
(2R)-2-amino-N-(3-ethenoxypropyl)propanamide has a molecular weight of 172.23 g/mol, XLogP of -0.00, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-(3-ethenoxypropyl)propanamide is sourced from PubChem (CID 78973332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).