2-methyl-2-(3-methylbutoxy)-N-pentan-3-ylpropanamide

C14H29NO2 — CID 146205300

IUPAC2-methyl-2-(3-methylbutoxy)-N-pentan-3-ylpropanamide
SMILESCCC(CC)NC(=O)C(C)(C)OCCC(C)C
InChIInChI=1S/C14H29NO2/c1-7-12(8-2)15-13(16)14(5,6)17-10-9-11(3)4/h11-12H,7-10H2,1-6H3,(H,15,16)
InChIKeyUCWKTXUMJBBTJE-UHFFFAOYSA-N
MW243.39 g/mol
LogP3.13
Rot. Bonds8

About 2-methyl-2-(3-methylbutoxy)-N-pentan-3-ylpropanamide

2-methyl-2-(3-methylbutoxy)-N-pentan-3-ylpropanamide (PubChem CID 146205300) has the molecular formula C14H29NO2 and a molecular weight of 243.39 g/mol. Its IUPAC name is 2-methyl-2-(3-methylbutoxy)-N-pentan-3-ylpropanamide.

Molecular Properties

Compound Name2-methyl-2-(3-methylbutoxy)-N-pentan-3-ylpropanamide
PubChem CID146205300
Molecular FormulaC14H29NO2
Molecular Weight243.39 g/mol
Exact Mass243.22
IUPAC Name2-methyl-2-(3-methylbutoxy)-N-pentan-3-ylpropanamide
SMILESCCC(CC)NC(=O)C(C)(C)OCCC(C)C
InChIInChI=1S/C14H29NO2/c1-7-12(8-2)15-13(16)14(5,6)17-10-9-11(3)4/h11-12H,7-10H2,1-6H3,(H,15,16)
InChIKeyUCWKTXUMJBBTJE-UHFFFAOYSA-N
XLogP3.13
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.39
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-butan-2-yl-2-methyl-2-(3-methylbutoxy)propanamide;methanol
CID 142410133
2-methyl-2-(3-methylbutoxy)-N-propan-2-ylpropanamide
CID 155301439
N-[(2S)-1-hydroxybutan-2-yl]-2-methoxy-2-methylpropanamide
CID 105342956
N-[3-methyl-3-(3-methylbutoxy)butyl]propanamide
CID 147929425
2-methyl-2-(methylamino)-N-pentan-3-ylpropanamide
CID 62836185
N-(1-amino-1-sulfanylidenepentan-3-yl)-2-methoxy-2-methylpropanamide
CID 103020409
2-[2-methyl-2-(3-methylbutoxy)propoxy]ethyl N-heptatriacontan-19-ylcarbamate
CID 138487255
[2-[[2-(3-methoxy-3-methylbutoxy)-2-methylpropanoyl]amino]-3-tetradecanoyloxypropyl] tetradecanoate
CID 143880292
propanamide;2,2,4-trimethyl-4-(3-methylbutoxy)pentane
CID 167513215
2,2-dimethyl-N-(1-methylsulfonylbutan-2-yl)propanamide
CID 166778273
4-methyl-4-(3-methylbutoxy)pentanoic acid
CID 89044410
tert-butyl N-[3-methyl-3-(3-methylbutoxy)pentyl]carbamate
CID 118409061

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-(3-methylbutoxy)-N-pentan-3-ylpropanamide?
The IUPAC name of 2-methyl-2-(3-methylbutoxy)-N-pentan-3-ylpropanamide (CID 146205300) is 2-methyl-2-(3-methylbutoxy)-N-pentan-3-ylpropanamide.
What is the SMILES notation for 2-methyl-2-(3-methylbutoxy)-N-pentan-3-ylpropanamide?
The canonical SMILES for 2-methyl-2-(3-methylbutoxy)-N-pentan-3-ylpropanamide is CCC(CC)NC(=O)C(C)(C)OCCC(C)C.
What is the InChIKey of 2-methyl-2-(3-methylbutoxy)-N-pentan-3-ylpropanamide?
The InChIKey is UCWKTXUMJBBTJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO2/c1-7-12(8-2)15-13(16)14(5,6)17-10-9-11(3)4/h11-12H,7-10H2,1-6H3,(H,15,16).
What are the key properties of 2-methyl-2-(3-methylbutoxy)-N-pentan-3-ylpropanamide?
2-methyl-2-(3-methylbutoxy)-N-pentan-3-ylpropanamide has a molecular weight of 243.39 g/mol, XLogP of 3.13, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-(3-methylbutoxy)-N-pentan-3-ylpropanamide is sourced from PubChem (CID 146205300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).