N-(2-amino-2-oxoethyl)-2,2-dimethyl-N-propylhexanamide

C13H26N2O2 — CID 130279567

IUPACN-(2-amino-2-oxoethyl)-2,2-dimethyl-N-propylhexanamide
SMILESCCCCC(C)(C)C(=O)N(CCC)CC(N)=O
InChIInChI=1S/C13H26N2O2/c1-5-7-8-13(3,4)12(17)15(9-6-2)10-11(14)16/h5-10H2,1-4H3,(H2,14,16)
InChIKeyFGYLJOHFXFTFGQ-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.93
Rot. Bonds8

About N-(2-amino-2-oxoethyl)-2,2-dimethyl-N-propylhexanamide

N-(2-amino-2-oxoethyl)-2,2-dimethyl-N-propylhexanamide (PubChem CID 130279567) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-2,2-dimethyl-N-propylhexanamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-2,2-dimethyl-N-propylhexanamide
PubChem CID130279567
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC NameN-(2-amino-2-oxoethyl)-2,2-dimethyl-N-propylhexanamide
SMILESCCCCC(C)(C)C(=O)N(CCC)CC(N)=O
InChIInChI=1S/C13H26N2O2/c1-5-7-8-13(3,4)12(17)15(9-6-2)10-11(14)16/h5-10H2,1-4H3,(H2,14,16)
InChIKeyFGYLJOHFXFTFGQ-UHFFFAOYSA-N
XLogP1.93
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,2-dimethylhexadecanamide
CID 23297438
2,2-dimethyldecanamide
CID 22596903
N-(2-amino-2-oxoethyl)-N-propylbutanamide
CID 57237794
N-(2-amino-2-oxoethyl)-3-chloro-N-ethyl-2,2-dimethylpropanamide
CID 103101636
2-tert-butyl-2-methylhexanamide
CID 175947607
(2R)-2-amino-N-(2-amino-2-oxoethyl)-N-butyl-3,3-dimethylbutanamide
CID 103929250
2-[(2-amino-2-oxoethyl)-(dibutylcarbamoyl)amino]acetic acid
CID 107437530
3-chloro-2,2-dimethyl-N,N-dipropylpropanamide
CID 63680887
methyl 2-[2,2-dimethylbutanoyl(propyl)amino]acetate
CID 62679600
2-[(2-amino-2-oxoethyl)-[propyl(2,2,2-trifluoroethyl)carbamoyl]amino]acetic acid
CID 107438469
2,2,4,4-tetramethyloctanamide
CID 89265851
(2R)-2-amino-N-(2-amino-2-oxoethyl)-N-butyl-3-methylbutanamide
CID 79013579

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-2,2-dimethyl-N-propylhexanamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-2,2-dimethyl-N-propylhexanamide (CID 130279567) is N-(2-amino-2-oxoethyl)-2,2-dimethyl-N-propylhexanamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-2,2-dimethyl-N-propylhexanamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-2,2-dimethyl-N-propylhexanamide is CCCCC(C)(C)C(=O)N(CCC)CC(N)=O.
What is the InChIKey of N-(2-amino-2-oxoethyl)-2,2-dimethyl-N-propylhexanamide?
The InChIKey is FGYLJOHFXFTFGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-5-7-8-13(3,4)12(17)15(9-6-2)10-11(14)16/h5-10H2,1-4H3,(H2,14,16).
What are the key properties of N-(2-amino-2-oxoethyl)-2,2-dimethyl-N-propylhexanamide?
N-(2-amino-2-oxoethyl)-2,2-dimethyl-N-propylhexanamide has a molecular weight of 242.36 g/mol, XLogP of 1.93, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-2,2-dimethyl-N-propylhexanamide is sourced from PubChem (CID 130279567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).