N,N-diethyl-2-(1-hydroxyethyl)undec-10-enamide

C17H33NO2 — CID 10945964

IUPACN,N-diethyl-2-(1-hydroxyethyl)undec-10-enamide
SMILESC=CCCCCCCCC(C(=O)N(CC)CC)C(C)O
InChIInChI=1S/C17H33NO2/c1-5-8-9-10-11-12-13-14-16(15(4)19)17(20)18(6-2)7-3/h5,15-16,19H,1,6-14H2,2-4H3
InChIKeyDLYKHYSKJQUNFH-UHFFFAOYSA-N
MW283.46 g/mol
LogP3.77
Rot. Bonds12

About N,N-diethyl-2-(1-hydroxyethyl)undec-10-enamide

N,N-diethyl-2-(1-hydroxyethyl)undec-10-enamide (PubChem CID 10945964) has the molecular formula C17H33NO2 and a molecular weight of 283.46 g/mol. Its IUPAC name is N,N-diethyl-2-(1-hydroxyethyl)undec-10-enamide.

Molecular Properties

Compound NameN,N-diethyl-2-(1-hydroxyethyl)undec-10-enamide
PubChem CID10945964
Molecular FormulaC17H33NO2
Molecular Weight283.46 g/mol
Exact Mass283.25
IUPAC NameN,N-diethyl-2-(1-hydroxyethyl)undec-10-enamide
SMILESC=CCCCCCCCC(C(=O)N(CC)CC)C(C)O
InChIInChI=1S/C17H33NO2/c1-5-8-9-10-11-12-13-14-16(15(4)19)17(20)18(6-2)7-3/h5,15-16,19H,1,6-14H2,2-4H3
InChIKeyDLYKHYSKJQUNFH-UHFFFAOYSA-N
XLogP3.77
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.46
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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,N-di-methyl-3-hydroxy-2-hexyl-4-pentenamide
CID 14815151
erythro-N,N-dimethyl-3-hydroxy-2-methyl-2-hexyl-4-pentenamide
CID 14815154
actinium;(2S)-2-[(2R)-1-hydroxy-2-methylpent-4-enyl]-1-methyl-azacyclotridecan-3-one
CID 59084203
(Z)-2-ethyl-12-hydroxy-N,N-bis(hydroxymethyl)octadec-9-enamide
CID 139887018
(Z)-12-hydroxy-N,N-bis(hydroxymethyl)-2-propyloctadec-9-enamide
CID 139887026
(Z)-2-(1-hydroxyethyl)-N,N-dimethyloctadec-9-enamide;hydrochloride
CID 174990439
(2S,3S)-2-butyl-N,N-diethyl-3-hydroxynonanamide
CID 10755586
2-ethenyl-3-hydroxy-N-(2-methylpropyl)octanamide
CID 10911690
2-(1-hydroxyethyl)-N,N-di(propan-2-yl)undec-10-enamide
CID 15877649
(2S)-2-[(2R)-1-hydroxy-2-methylpent-4-enyl]-1-methyl-azacyclotridecan-3-one
CID 59084204
(5R,7R)-7-hydroxy-N,5,8,8-tetramethyl-N-prop-2-enylnonanamide
CID 71474838
(5R,7S)-7-hydroxy-N,5,8,8-tetramethyl-N-prop-2-enylnonanamide
CID 101909988

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-(1-hydroxyethyl)undec-10-enamide?
The IUPAC name of N,N-diethyl-2-(1-hydroxyethyl)undec-10-enamide (CID 10945964) is N,N-diethyl-2-(1-hydroxyethyl)undec-10-enamide.
What is the SMILES notation for N,N-diethyl-2-(1-hydroxyethyl)undec-10-enamide?
The canonical SMILES for N,N-diethyl-2-(1-hydroxyethyl)undec-10-enamide is C=CCCCCCCCC(C(=O)N(CC)CC)C(C)O.
What is the InChIKey of N,N-diethyl-2-(1-hydroxyethyl)undec-10-enamide?
The InChIKey is DLYKHYSKJQUNFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33NO2/c1-5-8-9-10-11-12-13-14-16(15(4)19)17(20)18(6-2)7-3/h5,15-16,19H,1,6-14H2,2-4H3.
What are the key properties of N,N-diethyl-2-(1-hydroxyethyl)undec-10-enamide?
N,N-diethyl-2-(1-hydroxyethyl)undec-10-enamide has a molecular weight of 283.46 g/mol, XLogP of 3.77, 12 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-(1-hydroxyethyl)undec-10-enamide is sourced from PubChem (CID 10945964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).