N-(2-hydroxyethyl)-2,2-dimethyl-N-pentylpropanamide

C12H25NO2 — CID 59440869

IUPACN-(2-hydroxyethyl)-2,2-dimethyl-N-pentylpropanamide
SMILESCCCCCN(CCO)C(=O)C(C)(C)C
InChIInChI=1S/C12H25NO2/c1-5-6-7-8-13(9-10-14)11(15)12(2,3)4/h14H,5-10H2,1-4H3
InChIKeyRDNSNBIWJHOGPG-UHFFFAOYSA-N
MW215.34 g/mol
LogP2.04
Rot. Bonds6

About N-(2-hydroxyethyl)-2,2-dimethyl-N-pentylpropanamide

N-(2-hydroxyethyl)-2,2-dimethyl-N-pentylpropanamide (PubChem CID 59440869) has the molecular formula C12H25NO2 and a molecular weight of 215.34 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-2,2-dimethyl-N-pentylpropanamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-2,2-dimethyl-N-pentylpropanamide
PubChem CID59440869
Molecular FormulaC12H25NO2
Molecular Weight215.34 g/mol
Exact Mass215.19
IUPAC NameN-(2-hydroxyethyl)-2,2-dimethyl-N-pentylpropanamide
SMILESCCCCCN(CCO)C(=O)C(C)(C)C
InChIInChI=1S/C12H25NO2/c1-5-6-7-8-13(9-10-14)11(15)12(2,3)4/h14H,5-10H2,1-4H3
InChIKeyRDNSNBIWJHOGPG-UHFFFAOYSA-N
XLogP2.04
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 52.04
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

2,2-dimethyl-N,N-di(nonyl)propanamide
CID 532840
3-amino-N-hexyl-N-(2-hydroxyethyl)-2,2-dimethylpropanamide
CID 113307587
2,2-dimethyl-N,N-dipropylpropanamide;methane
CID 157106915
2-amino-N,N-dihexyl-2-methylpropanamide
CID 61265821
2-[bis(2-hydroxyethyl)carbamoyl]-2-methylhexadecanoic acid
CID 101279151
2-methoxy-2-methyl-N,N-dipentylpropanamide
CID 103028912
1-hexadecyl-1-(2-hydroxyethyl)-3-methylurea
CID 88673985
3-[2,2-dimethylpropanoyl(3-hydroxypropyl)amino]propanoic acid
CID 82323720
potassium 2-[bis(2-hydroxyethyl)carbamoyl]-2-methyltetradecanoate
CID 101279146
3-[hexyl(2-hydroxyethyl)amino]-3-oxopropanoic acid
CID 62230259
N-butyl-N',N'-bis(2-hydroxyethyl)-N-propyloxamide
CID 108509852
3-amino-N-butyl-N-(2-hydroxyethyl)-3-methylbutanamide
CID 64684879

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-2,2-dimethyl-N-pentylpropanamide?
The IUPAC name of N-(2-hydroxyethyl)-2,2-dimethyl-N-pentylpropanamide (CID 59440869) is N-(2-hydroxyethyl)-2,2-dimethyl-N-pentylpropanamide.
What is the SMILES notation for N-(2-hydroxyethyl)-2,2-dimethyl-N-pentylpropanamide?
The canonical SMILES for N-(2-hydroxyethyl)-2,2-dimethyl-N-pentylpropanamide is CCCCCN(CCO)C(=O)C(C)(C)C.
What is the InChIKey of N-(2-hydroxyethyl)-2,2-dimethyl-N-pentylpropanamide?
The InChIKey is RDNSNBIWJHOGPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO2/c1-5-6-7-8-13(9-10-14)11(15)12(2,3)4/h14H,5-10H2,1-4H3.
What are the key properties of N-(2-hydroxyethyl)-2,2-dimethyl-N-pentylpropanamide?
N-(2-hydroxyethyl)-2,2-dimethyl-N-pentylpropanamide has a molecular weight of 215.34 g/mol, XLogP of 2.04, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-2,2-dimethyl-N-pentylpropanamide is sourced from PubChem (CID 59440869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).