N-[4-(2-methoxyethoxy)phenyl]-2-(prop-2-enylamino)acetamide

C14H20N2O3 — CID 54818436

IUPACN-[4-(2-methoxyethoxy)phenyl]-2-(prop-2-enylamino)acetamide
SMILESC=CCNCC(=O)Nc1ccc(OCCOC)cc1
InChIInChI=1S/C14H20N2O3/c1-3-8-15-11-14(17)16-12-4-6-13(7-5-12)19-10-9-18-2/h3-7,15H,1,8-11H2,2H3,(H,16,17)
InChIKeyKSABAJTWUQPRML-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.43
Rot. Bonds9

About N-[4-(2-methoxyethoxy)phenyl]-2-(prop-2-enylamino)acetamide

N-[4-(2-methoxyethoxy)phenyl]-2-(prop-2-enylamino)acetamide (PubChem CID 54818436) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is N-[4-(2-methoxyethoxy)phenyl]-2-(prop-2-enylamino)acetamide.

Molecular Properties

Compound NameN-[4-(2-methoxyethoxy)phenyl]-2-(prop-2-enylamino)acetamide
PubChem CID54818436
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC NameN-[4-(2-methoxyethoxy)phenyl]-2-(prop-2-enylamino)acetamide
SMILESC=CCNCC(=O)Nc1ccc(OCCOC)cc1
InChIInChI=1S/C14H20N2O3/c1-3-8-15-11-14(17)16-12-4-6-13(7-5-12)19-10-9-18-2/h3-7,15H,1,8-11H2,2H3,(H,16,17)
InChIKeyKSABAJTWUQPRML-UHFFFAOYSA-N
XLogP1.43
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(4-heptoxyphenyl)-2-(prop-2-enylamino)acetamide
CID 54818376
2-(hexadecylamino)-N-[4-(2-methoxyethoxy)phenyl]acetamide
CID 54808989
N-[4-(2-methoxyethoxy)phenyl]-2-(methylamino)acetamide;hydrochloride
CID 119723419
methyl 3-[4-(2-methoxyethoxy)anilino]-3-oxopropanoate
CID 28638031
2-(4-ethoxyanilino)-N-[4-(2-methoxyethoxy)phenyl]acetamide
CID 54811661
N-[4-(2-methoxyethoxy)phenyl]-4-prop-2-enoxybenzamide
CID 17340476
1-[4-(2-methoxyethoxy)phenyl]-3-prop-2-enylthiourea
CID 26169463
N-(4-chlorophenyl)-2-[4-(2-methoxyethoxy)anilino]acetamide
CID 54822618
N-(3-bromo-4-methoxyphenyl)-2-(prop-2-enylamino)acetamide
CID 79280621
5-chloro-N-[4-(2-methoxyethoxy)phenyl]pentanamide
CID 43701603
N-(4-methoxy-3-methylphenyl)-2-(prop-2-enylamino)acetamide
CID 79280189
methyl N-[4-(2-methoxyethoxy)phenyl]carbamate
CID 110777023

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-methoxyethoxy)phenyl]-2-(prop-2-enylamino)acetamide?
The IUPAC name of N-[4-(2-methoxyethoxy)phenyl]-2-(prop-2-enylamino)acetamide (CID 54818436) is N-[4-(2-methoxyethoxy)phenyl]-2-(prop-2-enylamino)acetamide.
What is the SMILES notation for N-[4-(2-methoxyethoxy)phenyl]-2-(prop-2-enylamino)acetamide?
The canonical SMILES for N-[4-(2-methoxyethoxy)phenyl]-2-(prop-2-enylamino)acetamide is C=CCNCC(=O)Nc1ccc(OCCOC)cc1.
What is the InChIKey of N-[4-(2-methoxyethoxy)phenyl]-2-(prop-2-enylamino)acetamide?
The InChIKey is KSABAJTWUQPRML-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-3-8-15-11-14(17)16-12-4-6-13(7-5-12)19-10-9-18-2/h3-7,15H,1,8-11H2,2H3,(H,16,17).
What are the key properties of N-[4-(2-methoxyethoxy)phenyl]-2-(prop-2-enylamino)acetamide?
N-[4-(2-methoxyethoxy)phenyl]-2-(prop-2-enylamino)acetamide has a molecular weight of 264.32 g/mol, XLogP of 1.43, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-methoxyethoxy)phenyl]-2-(prop-2-enylamino)acetamide is sourced from PubChem (CID 54818436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).