N-(3-ethoxypropyl)-2,2-dimethylpropanamide

C10H21NO2 — CID 60717995

IUPACN-(3-ethoxypropyl)-2,2-dimethylpropanamide
SMILESCCOCCCNC(=O)C(C)(C)C
InChIInChI=1S/C10H21NO2/c1-5-13-8-6-7-11-9(12)10(2,3)4/h5-8H2,1-4H3,(H,11,12)
InChIKeyFCFBFYHDJLSTNS-UHFFFAOYSA-N
MW187.28 g/mol
LogP1.58
Rot. Bonds5

About N-(3-ethoxypropyl)-2,2-dimethylpropanamide

N-(3-ethoxypropyl)-2,2-dimethylpropanamide (PubChem CID 60717995) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is N-(3-ethoxypropyl)-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-(3-ethoxypropyl)-2,2-dimethylpropanamide
PubChem CID60717995
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC NameN-(3-ethoxypropyl)-2,2-dimethylpropanamide
SMILESCCOCCCNC(=O)C(C)(C)C
InChIInChI=1S/C10H21NO2/c1-5-13-8-6-7-11-9(12)10(2,3)4/h5-8H2,1-4H3,(H,11,12)
InChIKeyFCFBFYHDJLSTNS-UHFFFAOYSA-N
XLogP1.58
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-amino-N-(3-ethoxypropyl)-2,2,3-trimethylbutanamide
CID 65264682
2,2,2-tribromo-N-(3-ethoxypropyl)acetamide
CID 20741094
N-(4-ethoxybutyl)-2,2,2-trifluoroacetamide
CID 130756999
N-(3-methoxypropyl)-2,2-dimethylpropanamide
CID 4152468
2-amino-N-(3-ethoxypropyl)-2-methylpentanamide
CID 60848573
tert-butyl N-(3-ethoxypropyl)carbamate
CID 63787963
2,2-dimethyl-N-[3-[3-(propan-2-ylamino)propoxy]propyl]propanamide
CID 170038260
1-(3-ethoxypropyl)-3-ethylurea
CID 108890430
N-[3-(2-ethoxyethoxy)propyl]acetamide
CID 129212456
4-(3-ethoxypropylamino)-2,2-dimethyl-4-oxobutanoic acid
CID 65297863
(2S)-2-amino-N-(3-ethoxypropyl)-3,3-dimethylbutanamide;hydrochloride
CID 119675575
2,2-dimethyl-N-tetradecylpropanamide
CID 11220230

Frequently Asked Questions

What is the IUPAC name of N-(3-ethoxypropyl)-2,2-dimethylpropanamide?
The IUPAC name of N-(3-ethoxypropyl)-2,2-dimethylpropanamide (CID 60717995) is N-(3-ethoxypropyl)-2,2-dimethylpropanamide.
What is the SMILES notation for N-(3-ethoxypropyl)-2,2-dimethylpropanamide?
The canonical SMILES for N-(3-ethoxypropyl)-2,2-dimethylpropanamide is CCOCCCNC(=O)C(C)(C)C.
What is the InChIKey of N-(3-ethoxypropyl)-2,2-dimethylpropanamide?
The InChIKey is FCFBFYHDJLSTNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-5-13-8-6-7-11-9(12)10(2,3)4/h5-8H2,1-4H3,(H,11,12).
What are the key properties of N-(3-ethoxypropyl)-2,2-dimethylpropanamide?
N-(3-ethoxypropyl)-2,2-dimethylpropanamide has a molecular weight of 187.28 g/mol, XLogP of 1.58, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethoxypropyl)-2,2-dimethylpropanamide is sourced from PubChem (CID 60717995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).