3-amino-N-(2-methoxyethyl)-N-(2-methylpropyl)oxolane-3-carboxamide

C12H24N2O3 — CID 64891152

IUPAC3-amino-N-(2-methoxyethyl)-N-(2-methylpropyl)oxolane-3-carboxamide
SMILESCOCCN(CC(C)C)C(=O)C1(N)CCOC1
InChIInChI=1S/C12H24N2O3/c1-10(2)8-14(5-7-16-3)11(15)12(13)4-6-17-9-12/h10H,4-9,13H2,1-3H3
InChIKeyZYIDVWMNUNYRQP-UHFFFAOYSA-N
MW244.33 g/mol
LogP0.24
Rot. Bonds6

About 3-amino-N-(2-methoxyethyl)-N-(2-methylpropyl)oxolane-3-carboxamide

3-amino-N-(2-methoxyethyl)-N-(2-methylpropyl)oxolane-3-carboxamide (PubChem CID 64891152) has the molecular formula C12H24N2O3 and a molecular weight of 244.33 g/mol. Its IUPAC name is 3-amino-N-(2-methoxyethyl)-N-(2-methylpropyl)oxolane-3-carboxamide.

Molecular Properties

Compound Name3-amino-N-(2-methoxyethyl)-N-(2-methylpropyl)oxolane-3-carboxamide
PubChem CID64891152
Molecular FormulaC12H24N2O3
Molecular Weight244.33 g/mol
Exact Mass244.18
IUPAC Name3-amino-N-(2-methoxyethyl)-N-(2-methylpropyl)oxolane-3-carboxamide
SMILESCOCCN(CC(C)C)C(=O)C1(N)CCOC1
InChIInChI=1S/C12H24N2O3/c1-10(2)8-14(5-7-16-3)11(15)12(13)4-6-17-9-12/h10H,4-9,13H2,1-3H3
InChIKeyZYIDVWMNUNYRQP-UHFFFAOYSA-N
XLogP0.24
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.33
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 3-[(3-aminooxolane-3-carbonyl)-(2-methylpropyl)amino]propanoate
CID 64890962
3-amino-N-ethyl-N-(2-methylpropyl)oxolane-3-carboxamide
CID 64892702
4-amino-N-ethyl-N-(2-methoxyethyl)oxane-4-carboxamide
CID 115294699
3-amino-N,N-bis(2-ethoxyethyl)oxolane-3-carboxamide
CID 82966183
4-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)oxane-4-carboxamide
CID 115294429
4-amino-N-(2-methoxyethyl)-N-propan-2-yloxane-4-carboxamide
CID 82948017
3-amino-N-cyclopropyl-N-(3-methylbutyl)oxolane-3-carboxamide
CID 64892755
1-(3-aminooxolan-3-yl)-4-methoxy-2-methylbutan-1-one
CID 116579573
3-amino-N-butan-2-yl-N-ethyloxolane-3-carboxamide
CID 64892703
3-amino-N-propan-2-yl-N-propyloxolane-3-carboxamide
CID 64892499
1-amino-N,N-bis(2-methoxyethyl)cyclohexane-1-carboxamide;hydrochloride
CID 119262683
1-amino-N-[2-(dimethylamino)ethyl]-N-(2-methylpropyl)cyclopropane-1-carboxamide
CID 65464903

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-methoxyethyl)-N-(2-methylpropyl)oxolane-3-carboxamide?
The IUPAC name of 3-amino-N-(2-methoxyethyl)-N-(2-methylpropyl)oxolane-3-carboxamide (CID 64891152) is 3-amino-N-(2-methoxyethyl)-N-(2-methylpropyl)oxolane-3-carboxamide.
What is the SMILES notation for 3-amino-N-(2-methoxyethyl)-N-(2-methylpropyl)oxolane-3-carboxamide?
The canonical SMILES for 3-amino-N-(2-methoxyethyl)-N-(2-methylpropyl)oxolane-3-carboxamide is COCCN(CC(C)C)C(=O)C1(N)CCOC1.
What is the InChIKey of 3-amino-N-(2-methoxyethyl)-N-(2-methylpropyl)oxolane-3-carboxamide?
The InChIKey is ZYIDVWMNUNYRQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O3/c1-10(2)8-14(5-7-16-3)11(15)12(13)4-6-17-9-12/h10H,4-9,13H2,1-3H3.
What are the key properties of 3-amino-N-(2-methoxyethyl)-N-(2-methylpropyl)oxolane-3-carboxamide?
3-amino-N-(2-methoxyethyl)-N-(2-methylpropyl)oxolane-3-carboxamide has a molecular weight of 244.33 g/mol, XLogP of 0.24, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-methoxyethyl)-N-(2-methylpropyl)oxolane-3-carboxamide is sourced from PubChem (CID 64891152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).