N,N-diethyl-2-(oxolan-3-ylmethylamino)propanamide

C12H24N2O2 — CID 43433587

IUPACN,N-diethyl-2-(oxolan-3-ylmethylamino)propanamide
SMILESCCN(CC)C(=O)C(C)NCC1CCOC1
InChIInChI=1S/C12H24N2O2/c1-4-14(5-2)12(15)10(3)13-8-11-6-7-16-9-11/h10-11,13H,4-9H2,1-3H3
InChIKeyKEYHKZDDCDKEGW-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.87
Rot. Bonds6

About N,N-diethyl-2-(oxolan-3-ylmethylamino)propanamide

N,N-diethyl-2-(oxolan-3-ylmethylamino)propanamide (PubChem CID 43433587) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is N,N-diethyl-2-(oxolan-3-ylmethylamino)propanamide.

Molecular Properties

Compound NameN,N-diethyl-2-(oxolan-3-ylmethylamino)propanamide
PubChem CID43433587
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC NameN,N-diethyl-2-(oxolan-3-ylmethylamino)propanamide
SMILESCCN(CC)C(=O)C(C)NCC1CCOC1
InChIInChI=1S/C12H24N2O2/c1-4-14(5-2)12(15)10(3)13-8-11-6-7-16-9-11/h10-11,13H,4-9H2,1-3H3
InChIKeyKEYHKZDDCDKEGW-UHFFFAOYSA-N
XLogP0.87
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-N-methyl-2-(oxan-3-ylmethylamino)propanamide
CID 103106976
(2S)-2-amino-N-ethyl-N-(oxolan-3-ylmethyl)propanamide
CID 61148831
3-amino-N-ethyl-2-methyl-N-(oxolan-3-ylmethyl)propanamide
CID 62668913
2-(oxolan-3-ylmethylamino)butanoic acid
CID 64668954
3-methyl-2-(oxolan-3-ylmethylamino)butanoic acid
CID 61313229
N,N-dimethyl-3-(oxolan-3-ylmethylamino)butanamide
CID 115712358
2-(oxolan-3-ylmethylamino)-N-(2,2,2-trifluoroethyl)propanamide
CID 115581038
2-(cyclopropylamino)-N,N-diethylpropanamide
CID 43113043
N-ethyl-N-(oxolan-3-ylmethyl)-3-(propan-2-ylamino)propanamide
CID 54874267
N-ethyl-3-methyl-N-(oxolan-3-ylmethyl)butanamide
CID 51082548
N-ethyl-3-methyl-N-[[(3S)-oxolan-3-yl]methyl]butanamide
CID 94186751
2-methyl-N-(oxolan-3-ylmethyl)butan-1-amine
CID 60919551

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-(oxolan-3-ylmethylamino)propanamide?
The IUPAC name of N,N-diethyl-2-(oxolan-3-ylmethylamino)propanamide (CID 43433587) is N,N-diethyl-2-(oxolan-3-ylmethylamino)propanamide.
What is the SMILES notation for N,N-diethyl-2-(oxolan-3-ylmethylamino)propanamide?
The canonical SMILES for N,N-diethyl-2-(oxolan-3-ylmethylamino)propanamide is CCN(CC)C(=O)C(C)NCC1CCOC1.
What is the InChIKey of N,N-diethyl-2-(oxolan-3-ylmethylamino)propanamide?
The InChIKey is KEYHKZDDCDKEGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-4-14(5-2)12(15)10(3)13-8-11-6-7-16-9-11/h10-11,13H,4-9H2,1-3H3.
What are the key properties of N,N-diethyl-2-(oxolan-3-ylmethylamino)propanamide?
N,N-diethyl-2-(oxolan-3-ylmethylamino)propanamide has a molecular weight of 228.34 g/mol, XLogP of 0.87, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-(oxolan-3-ylmethylamino)propanamide is sourced from PubChem (CID 43433587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).