2-[2-(2-hydroxyethoxy)ethylamino]-N-prop-2-ynylpropanamide

C10H18N2O3 — CID 60720256

IUPAC2-[2-(2-hydroxyethoxy)ethylamino]-N-prop-2-ynylpropanamide
SMILESC#CCNC(=O)C(C)NCCOCCO
InChIInChI=1S/C10H18N2O3/c1-3-4-12-10(14)9(2)11-5-7-15-8-6-13/h1,9,11,13H,4-8H2,2H3,(H,12,14)
InChIKeyNIWLTSYSWDOUEY-UHFFFAOYSA-N
MW214.26 g/mol
LogP-1.28
Rot. Bonds8

About 2-[2-(2-hydroxyethoxy)ethylamino]-N-prop-2-ynylpropanamide

2-[2-(2-hydroxyethoxy)ethylamino]-N-prop-2-ynylpropanamide (PubChem CID 60720256) has the molecular formula C10H18N2O3 and a molecular weight of 214.26 g/mol. Its IUPAC name is 2-[2-(2-hydroxyethoxy)ethylamino]-N-prop-2-ynylpropanamide.

Molecular Properties

Compound Name2-[2-(2-hydroxyethoxy)ethylamino]-N-prop-2-ynylpropanamide
PubChem CID60720256
Molecular FormulaC10H18N2O3
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC Name2-[2-(2-hydroxyethoxy)ethylamino]-N-prop-2-ynylpropanamide
SMILESC#CCNC(=O)C(C)NCCOCCO
InChIInChI=1S/C10H18N2O3/c1-3-4-12-10(14)9(2)11-5-7-15-8-6-13/h1,9,11,13H,4-8H2,2H3,(H,12,14)
InChIKeyNIWLTSYSWDOUEY-UHFFFAOYSA-N
XLogP-1.28
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 5-1.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(2-hydroxyethoxy)ethylamino]-N-propan-2-ylpropanamide
CID 60654173
2-(2-aminoethylamino)-N-prop-2-ynylpropanamide
CID 62140900
3-[[1-oxo-1-(prop-2-ynylamino)propan-2-yl]amino]propanoic acid
CID 43466719
2-[(5-hydroxy-4-methylpentyl)amino]-N-prop-2-ynylpropanamide
CID 106160085
2-[(4-hydroxy-2-methylbutyl)amino]-N-prop-2-ynylpropanamide
CID 66107036
2-[2-(2-hydroxyethoxy)ethylamino]-N-(2-methylbutan-2-yl)propanamide
CID 60720233
2-(2-methylprop-2-enylamino)-N-prop-2-ynylpropanamide
CID 114616816
2-[2-(2-hydroxyethoxy)ethylamino]-N,N-dimethylpropanamide
CID 60672617
2-amino-N-[2-(2-hydroxyethoxy)ethyl]pent-4-ynamide
CID 115563193
2-[2-(diethylamino)ethylamino]-N-prop-2-ynylpropanamide
CID 43112763
2-[3-(2-hydroxyethoxy)propylamino]-N-(2,2,2-trifluoroethyl)propanamide
CID 106309732
2-[2-[ethyl(propyl)amino]ethylamino]-N-prop-2-ynylpropanamide
CID 114133454

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-hydroxyethoxy)ethylamino]-N-prop-2-ynylpropanamide?
The IUPAC name of 2-[2-(2-hydroxyethoxy)ethylamino]-N-prop-2-ynylpropanamide (CID 60720256) is 2-[2-(2-hydroxyethoxy)ethylamino]-N-prop-2-ynylpropanamide.
What is the SMILES notation for 2-[2-(2-hydroxyethoxy)ethylamino]-N-prop-2-ynylpropanamide?
The canonical SMILES for 2-[2-(2-hydroxyethoxy)ethylamino]-N-prop-2-ynylpropanamide is C#CCNC(=O)C(C)NCCOCCO.
What is the InChIKey of 2-[2-(2-hydroxyethoxy)ethylamino]-N-prop-2-ynylpropanamide?
The InChIKey is NIWLTSYSWDOUEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3/c1-3-4-12-10(14)9(2)11-5-7-15-8-6-13/h1,9,11,13H,4-8H2,2H3,(H,12,14).
What are the key properties of 2-[2-(2-hydroxyethoxy)ethylamino]-N-prop-2-ynylpropanamide?
2-[2-(2-hydroxyethoxy)ethylamino]-N-prop-2-ynylpropanamide has a molecular weight of 214.26 g/mol, XLogP of -1.28, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-hydroxyethoxy)ethylamino]-N-prop-2-ynylpropanamide is sourced from PubChem (CID 60720256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).