3-(diethylamino)-N,N-di(propan-2-yl)propanamide

C13H28N2O — CID 22958968

IUPAC3-(diethylamino)-N,N-di(propan-2-yl)propanamide
SMILESCCN(CC)CCC(=O)N(C(C)C)C(C)C
InChIInChI=1S/C13H28N2O/c1-7-14(8-2)10-9-13(16)15(11(3)4)12(5)6/h11-12H,7-10H2,1-6H3
InChIKeyAQQCWHALWRQEGF-UHFFFAOYSA-N
MW228.38 g/mol
LogP2.36
Rot. Bonds7

About 3-(diethylamino)-N,N-di(propan-2-yl)propanamide

3-(diethylamino)-N,N-di(propan-2-yl)propanamide (PubChem CID 22958968) has the molecular formula C13H28N2O and a molecular weight of 228.38 g/mol. Its IUPAC name is 3-(diethylamino)-N,N-di(propan-2-yl)propanamide.

Molecular Properties

Compound Name3-(diethylamino)-N,N-di(propan-2-yl)propanamide
PubChem CID22958968
Molecular FormulaC13H28N2O
Molecular Weight228.38 g/mol
Exact Mass228.22
IUPAC Name3-(diethylamino)-N,N-di(propan-2-yl)propanamide
SMILESCCN(CC)CCC(=O)N(C(C)C)C(C)C
InChIInChI=1S/C13H28N2O/c1-7-14(8-2)10-9-13(16)15(11(3)4)12(5)6/h11-12H,7-10H2,1-6H3
InChIKeyAQQCWHALWRQEGF-UHFFFAOYSA-N
XLogP2.36
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 52.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Propanamide, 3-(dimethylamino)-N,N-dimethyl-
CID 62711
N,N-Diisopropylacetamide
CID 69797
1-Aziridinepropionamide, N,N-diethyl-
CID 57556
N,N-Diisopropyl-2-methylpropanamide
CID 221978
Propanamide, N,N-dipropyl-
CID 70687
N,N,N',N'-Tetraethylmalonamide
CID 551770
N,N,N',N'-Tetrapropylmalonamide
CID 2384358
N-[3-[acetyl(methyl)amino]propyl]-N-methylacetamide
CID 22908371
N,N-di(propan-2-yl)butanamide
CID 436861
3-(Dimethylamino)-N,N,N-trimethyl-3-oxopropan-1-aminium iodide
CID 87023
N-methyl-N-(propan-2-yl)propanamide
CID 18968516
3-(Dimethylamino)-1-(pyrrolidin-1-yl)propan-1-one
CID 78920271

Frequently Asked Questions

What is the IUPAC name of 3-(diethylamino)-N,N-di(propan-2-yl)propanamide?
The IUPAC name of 3-(diethylamino)-N,N-di(propan-2-yl)propanamide (CID 22958968) is 3-(diethylamino)-N,N-di(propan-2-yl)propanamide.
What is the SMILES notation for 3-(diethylamino)-N,N-di(propan-2-yl)propanamide?
The canonical SMILES for 3-(diethylamino)-N,N-di(propan-2-yl)propanamide is CCN(CC)CCC(=O)N(C(C)C)C(C)C.
What is the InChIKey of 3-(diethylamino)-N,N-di(propan-2-yl)propanamide?
The InChIKey is AQQCWHALWRQEGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O/c1-7-14(8-2)10-9-13(16)15(11(3)4)12(5)6/h11-12H,7-10H2,1-6H3.
What are the key properties of 3-(diethylamino)-N,N-di(propan-2-yl)propanamide?
3-(diethylamino)-N,N-di(propan-2-yl)propanamide has a molecular weight of 228.38 g/mol, XLogP of 2.36, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(diethylamino)-N,N-di(propan-2-yl)propanamide is sourced from PubChem (CID 22958968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).