N-[1-(dimethylamino)propan-2-yl]-N-ethyl-4-(propylamino)oxolane-3-carboxamide

C15H31N3O2 — CID 103188711

IUPACN-[1-(dimethylamino)propan-2-yl]-N-ethyl-4-(propylamino)oxolane-3-carboxamide
SMILESCCCNC1COCC1C(=O)N(CC)C(C)CN(C)C
InChIInChI=1S/C15H31N3O2/c1-6-8-16-14-11-20-10-13(14)15(19)18(7-2)12(3)9-17(4)5/h12-14,16H,6-11H2,1-5H3
InChIKeyXOZMDDZYTMOXQF-UHFFFAOYSA-N
MW285.43 g/mol
LogP0.80
Rot. Bonds8

About N-[1-(dimethylamino)propan-2-yl]-N-ethyl-4-(propylamino)oxolane-3-carboxamide

N-[1-(dimethylamino)propan-2-yl]-N-ethyl-4-(propylamino)oxolane-3-carboxamide (PubChem CID 103188711) has the molecular formula C15H31N3O2 and a molecular weight of 285.43 g/mol. Its IUPAC name is N-[1-(dimethylamino)propan-2-yl]-N-ethyl-4-(propylamino)oxolane-3-carboxamide.

Molecular Properties

Compound NameN-[1-(dimethylamino)propan-2-yl]-N-ethyl-4-(propylamino)oxolane-3-carboxamide
PubChem CID103188711
Molecular FormulaC15H31N3O2
Molecular Weight285.43 g/mol
Exact Mass285.24
IUPAC NameN-[1-(dimethylamino)propan-2-yl]-N-ethyl-4-(propylamino)oxolane-3-carboxamide
SMILESCCCNC1COCC1C(=O)N(CC)C(C)CN(C)C
InChIInChI=1S/C15H31N3O2/c1-6-8-16-14-11-20-10-13(14)15(19)18(7-2)12(3)9-17(4)5/h12-14,16H,6-11H2,1-5H3
InChIKeyXOZMDDZYTMOXQF-UHFFFAOYSA-N
XLogP0.80
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.43
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-[1-(dimethylamino)propan-2-yl]-N-ethyloxolane-3-carboxamide
CID 103188603
2-[methyl-[4-(propylamino)oxolane-3-carbonyl]amino]propanoic acid
CID 66255984
N-ethyl-N-(2-ethylbutyl)-4-(propylamino)oxolane-3-carboxamide
CID 66254601
N-[1-(diethylamino)propan-2-yl]-4-(propylamino)oxolane-3-carboxamide
CID 66255598
N-propan-2-yl-4-(propylamino)oxolane-3-carboxamide
CID 66254772
2-methyl-1-[4-(propylamino)oxolan-3-yl]propan-1-one
CID 116587663
2-[methyl-[4-(propylamino)oxolane-3-carbonyl]amino]butanoic acid
CID 66256930
N-cyclohexyl-N-methyl-4-(propylamino)oxolane-3-carboxamide
CID 66257070
N-(2-methoxyethyl)-N-methyl-4-(propylamino)oxolane-3-carboxamide
CID 66254816
2-methyl-1-[4-(propylamino)oxolan-3-yl]butan-1-one
CID 116587700
(2S)-2-[[4-(propylamino)oxolane-3-carbonyl]amino]propanoic acid
CID 66255015
N-methyl-N-[3-(methylamino)-3-oxopropyl]-4-(propylamino)oxolane-3-carboxamide
CID 106915220

Frequently Asked Questions

What is the IUPAC name of N-[1-(dimethylamino)propan-2-yl]-N-ethyl-4-(propylamino)oxolane-3-carboxamide?
The IUPAC name of N-[1-(dimethylamino)propan-2-yl]-N-ethyl-4-(propylamino)oxolane-3-carboxamide (CID 103188711) is N-[1-(dimethylamino)propan-2-yl]-N-ethyl-4-(propylamino)oxolane-3-carboxamide.
What is the SMILES notation for N-[1-(dimethylamino)propan-2-yl]-N-ethyl-4-(propylamino)oxolane-3-carboxamide?
The canonical SMILES for N-[1-(dimethylamino)propan-2-yl]-N-ethyl-4-(propylamino)oxolane-3-carboxamide is CCCNC1COCC1C(=O)N(CC)C(C)CN(C)C.
What is the InChIKey of N-[1-(dimethylamino)propan-2-yl]-N-ethyl-4-(propylamino)oxolane-3-carboxamide?
The InChIKey is XOZMDDZYTMOXQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O2/c1-6-8-16-14-11-20-10-13(14)15(19)18(7-2)12(3)9-17(4)5/h12-14,16H,6-11H2,1-5H3.
What are the key properties of N-[1-(dimethylamino)propan-2-yl]-N-ethyl-4-(propylamino)oxolane-3-carboxamide?
N-[1-(dimethylamino)propan-2-yl]-N-ethyl-4-(propylamino)oxolane-3-carboxamide has a molecular weight of 285.43 g/mol, XLogP of 0.80, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(dimethylamino)propan-2-yl]-N-ethyl-4-(propylamino)oxolane-3-carboxamide is sourced from PubChem (CID 103188711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).