N-ethyl-N-methyl-2-(oxan-3-ylmethylamino)propanamide

C12H24N2O2 — CID 103106976

IUPACN-ethyl-N-methyl-2-(oxan-3-ylmethylamino)propanamide
SMILESCCN(C)C(=O)C(C)NCC1CCCOC1
InChIInChI=1S/C12H24N2O2/c1-4-14(3)12(15)10(2)13-8-11-6-5-7-16-9-11/h10-11,13H,4-9H2,1-3H3
InChIKeyQHAOSGOBBOYZQQ-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.87
Rot. Bonds5

About N-ethyl-N-methyl-2-(oxan-3-ylmethylamino)propanamide

N-ethyl-N-methyl-2-(oxan-3-ylmethylamino)propanamide (PubChem CID 103106976) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is N-ethyl-N-methyl-2-(oxan-3-ylmethylamino)propanamide.

Molecular Properties

Compound NameN-ethyl-N-methyl-2-(oxan-3-ylmethylamino)propanamide
PubChem CID103106976
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC NameN-ethyl-N-methyl-2-(oxan-3-ylmethylamino)propanamide
SMILESCCN(C)C(=O)C(C)NCC1CCCOC1
InChIInChI=1S/C12H24N2O2/c1-4-14(3)12(15)10(2)13-8-11-6-5-7-16-9-11/h10-11,13H,4-9H2,1-3H3
InChIKeyQHAOSGOBBOYZQQ-UHFFFAOYSA-N
XLogP0.87
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
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

2-(cycloheptylmethylamino)-N-ethyl-N-methylpropanamide
CID 103107981
2-(cyclopropylmethylamino)-N-ethyl-N-methylpropanamide
CID 103106979
N,N-diethyl-2-(oxolan-3-ylmethylamino)propanamide
CID 43433587
2-[(4-tert-butylcyclohexyl)methylamino]-N-ethyl-N-methylpropanamide
CID 103107695
N-butyl-2-(oxan-3-ylmethylamino)propanamide
CID 54906033
N-ethyl-N-methyl-2-(oxan-2-ylmethylamino)propanamide
CID 103108703
N-tert-butyl-2-(oxan-3-ylmethylamino)propanamide
CID 54905939
1-morpholin-4-yl-2-(oxan-3-ylmethylamino)propan-1-one
CID 54905983
N-ethyl-N-methyl-2-(thiolan-3-ylmethylamino)propanamide
CID 107132515
2-methoxy-N-methyl-N-(oxan-3-ylmethyl)propanamide
CID 115618168
4-methyl-N-(oxan-3-ylmethyl)pentan-2-amine
CID 61020127
methyl 3-methyl-2-(oxan-3-ylmethylamino)pentanoate
CID 63739850

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-2-(oxan-3-ylmethylamino)propanamide?
The IUPAC name of N-ethyl-N-methyl-2-(oxan-3-ylmethylamino)propanamide (CID 103106976) is N-ethyl-N-methyl-2-(oxan-3-ylmethylamino)propanamide.
What is the SMILES notation for N-ethyl-N-methyl-2-(oxan-3-ylmethylamino)propanamide?
The canonical SMILES for N-ethyl-N-methyl-2-(oxan-3-ylmethylamino)propanamide is CCN(C)C(=O)C(C)NCC1CCCOC1.
What is the InChIKey of N-ethyl-N-methyl-2-(oxan-3-ylmethylamino)propanamide?
The InChIKey is QHAOSGOBBOYZQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-4-14(3)12(15)10(2)13-8-11-6-5-7-16-9-11/h10-11,13H,4-9H2,1-3H3.
What are the key properties of N-ethyl-N-methyl-2-(oxan-3-ylmethylamino)propanamide?
N-ethyl-N-methyl-2-(oxan-3-ylmethylamino)propanamide has a molecular weight of 228.34 g/mol, XLogP of 0.87, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-2-(oxan-3-ylmethylamino)propanamide is sourced from PubChem (CID 103106976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).