2-(2-methoxypropylamino)-N-prop-2-enylpropanamide

C10H20N2O2 — CID 102697960

IUPAC2-(2-methoxypropylamino)-N-prop-2-enylpropanamide
SMILESC=CCNC(=O)C(C)NCC(C)OC
InChIInChI=1S/C10H20N2O2/c1-5-6-11-10(13)9(3)12-7-8(2)14-4/h5,8-9,12H,1,6-7H2,2-4H3,(H,11,13)
InChIKeyKHHMXOZZMREHFJ-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.30
Rot. Bonds7

About 2-(2-methoxypropylamino)-N-prop-2-enylpropanamide

2-(2-methoxypropylamino)-N-prop-2-enylpropanamide (PubChem CID 102697960) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 2-(2-methoxypropylamino)-N-prop-2-enylpropanamide.

Molecular Properties

Compound Name2-(2-methoxypropylamino)-N-prop-2-enylpropanamide
PubChem CID102697960
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name2-(2-methoxypropylamino)-N-prop-2-enylpropanamide
SMILESC=CCNC(=O)C(C)NCC(C)OC
InChIInChI=1S/C10H20N2O2/c1-5-6-11-10(13)9(3)12-7-8(2)14-4/h5,8-9,12H,1,6-7H2,2-4H3,(H,11,13)
InChIKeyKHHMXOZZMREHFJ-UHFFFAOYSA-N
XLogP0.30
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-methoxy-N-prop-2-enylpropanamide
CID 100983783
2-hydroxy-3-[[1-oxo-1-(prop-2-enylamino)propan-2-yl]amino]propanamide
CID 106174665
N-butyl-2-(2-methoxypropylamino)propanamide
CID 102698101
ethyl 2-[[1-oxo-1-(prop-2-enylamino)propan-2-yl]amino]acetate
CID 60811246
2-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]-N-prop-2-enylpropanamide
CID 113219588
2-(cyclohexylmethylamino)-N-prop-2-enylpropanamide
CID 43216208
2-[(2-hydroxy-4-methoxy-2-methylbutyl)amino]-N-prop-2-enylpropanamide
CID 114164663
2-[[3-(diethylamino)-3-oxopropyl]amino]-N-prop-2-enylpropanamide
CID 113225823
2-methyl-N-prop-2-enylpropanamide;dihydrochloride
CID 174572104
2-[3-(diethylamino)propylamino]-N-prop-2-enylpropanamide
CID 43087344
(2S)-2-chloro-N-prop-2-enylpropanamide
CID 14203945
(2R)-2-methyl-N-prop-2-enylbutanamide
CID 55303611

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxypropylamino)-N-prop-2-enylpropanamide?
The IUPAC name of 2-(2-methoxypropylamino)-N-prop-2-enylpropanamide (CID 102697960) is 2-(2-methoxypropylamino)-N-prop-2-enylpropanamide.
What is the SMILES notation for 2-(2-methoxypropylamino)-N-prop-2-enylpropanamide?
The canonical SMILES for 2-(2-methoxypropylamino)-N-prop-2-enylpropanamide is C=CCNC(=O)C(C)NCC(C)OC.
What is the InChIKey of 2-(2-methoxypropylamino)-N-prop-2-enylpropanamide?
The InChIKey is KHHMXOZZMREHFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-5-6-11-10(13)9(3)12-7-8(2)14-4/h5,8-9,12H,1,6-7H2,2-4H3,(H,11,13).
What are the key properties of 2-(2-methoxypropylamino)-N-prop-2-enylpropanamide?
2-(2-methoxypropylamino)-N-prop-2-enylpropanamide has a molecular weight of 200.28 g/mol, XLogP of 0.30, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxypropylamino)-N-prop-2-enylpropanamide is sourced from PubChem (CID 102697960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).