N,N-diethyl-2-(pentan-2-ylamino)propanamide

C12H26N2O — CID 43113164

IUPACN,N-diethyl-2-(pentan-2-ylamino)propanamide
SMILESCCCC(C)NC(C)C(=O)N(CC)CC
InChIInChI=1S/C12H26N2O/c1-6-9-10(4)13-11(5)12(15)14(7-2)8-3/h10-11,13H,6-9H2,1-5H3
InChIKeyKOYIFOIIIMCKKX-UHFFFAOYSA-N
MW214.35 g/mol
LogP2.02
Rot. Bonds7

About N,N-diethyl-2-(pentan-2-ylamino)propanamide

N,N-diethyl-2-(pentan-2-ylamino)propanamide (PubChem CID 43113164) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is N,N-diethyl-2-(pentan-2-ylamino)propanamide.

Molecular Properties

Compound NameN,N-diethyl-2-(pentan-2-ylamino)propanamide
PubChem CID43113164
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC NameN,N-diethyl-2-(pentan-2-ylamino)propanamide
SMILESCCCC(C)NC(C)C(=O)N(CC)CC
InChIInChI=1S/C12H26N2O/c1-6-9-10(4)13-11(5)12(15)14(7-2)8-3/h10-11,13H,6-9H2,1-5H3
InChIKeyKOYIFOIIIMCKKX-UHFFFAOYSA-N
XLogP2.02
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(1-aminopropan-2-ylamino)-N,N-diethylpropanamide
CID 103388840
N,N-diethyl-2-(6,6,6-trifluorohexan-2-ylamino)propanamide
CID 116534471
N,N-diethyl-2-(1-methylsulfanylpropan-2-ylamino)propanamide
CID 115639005
N,N-diethyl-2-(4-phenylbutan-2-ylamino)propanamide
CID 43425172
2-[[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]amino]-N-pentan-2-ylpropanamide
CID 103108377
N,N-diethyl-2-[1-(4-fluorophenyl)propan-2-ylamino]propanamide
CID 62996918
2-(pentan-2-ylamino)-1-pyrrolidin-1-ylpropan-1-one
CID 43083652
N,N-diethyl-2-(methoxyamino)propanamide
CID 60721258
2-(1-cyclopentylethylamino)-N,N-diethylpropanamide
CID 62631567
(2S)-2-(pentan-2-ylamino)-1-piperidin-1-ylpropan-1-one
CID 103902059
N,N-diethyl-2-[(1-methoxy-3-methylbutan-2-yl)amino]propanamide
CID 65049413
2-(hexan-2-ylamino)-N-pentan-2-ylpropanamide
CID 62201162

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-(pentan-2-ylamino)propanamide?
The IUPAC name of N,N-diethyl-2-(pentan-2-ylamino)propanamide (CID 43113164) is N,N-diethyl-2-(pentan-2-ylamino)propanamide.
What is the SMILES notation for N,N-diethyl-2-(pentan-2-ylamino)propanamide?
The canonical SMILES for N,N-diethyl-2-(pentan-2-ylamino)propanamide is CCCC(C)NC(C)C(=O)N(CC)CC.
What is the InChIKey of N,N-diethyl-2-(pentan-2-ylamino)propanamide?
The InChIKey is KOYIFOIIIMCKKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-6-9-10(4)13-11(5)12(15)14(7-2)8-3/h10-11,13H,6-9H2,1-5H3.
What are the key properties of N,N-diethyl-2-(pentan-2-ylamino)propanamide?
N,N-diethyl-2-(pentan-2-ylamino)propanamide has a molecular weight of 214.35 g/mol, XLogP of 2.02, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-(pentan-2-ylamino)propanamide is sourced from PubChem (CID 43113164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).