N-(3-hydroxy-2,3-dimethylbutan-2-yl)-4-(methylamino)oxolane-3-carboxamide

C12H24N2O3 — CID 114155776

IUPACN-(3-hydroxy-2,3-dimethylbutan-2-yl)-4-(methylamino)oxolane-3-carboxamide
SMILESCNC1COCC1C(=O)NC(C)(C)C(C)(C)O
InChIInChI=1S/C12H24N2O3/c1-11(2,12(3,4)16)14-10(15)8-6-17-7-9(8)13-5/h8-9,13,16H,6-7H2,1-5H3,(H,14,15)
InChIKeyNTCHZSAJIPNPDN-UHFFFAOYSA-N
MW244.33 g/mol
LogP-0.11
Rot. Bonds4

About N-(3-hydroxy-2,3-dimethylbutan-2-yl)-4-(methylamino)oxolane-3-carboxamide

N-(3-hydroxy-2,3-dimethylbutan-2-yl)-4-(methylamino)oxolane-3-carboxamide (PubChem CID 114155776) has the molecular formula C12H24N2O3 and a molecular weight of 244.33 g/mol. Its IUPAC name is N-(3-hydroxy-2,3-dimethylbutan-2-yl)-4-(methylamino)oxolane-3-carboxamide.

Molecular Properties

Compound NameN-(3-hydroxy-2,3-dimethylbutan-2-yl)-4-(methylamino)oxolane-3-carboxamide
PubChem CID114155776
Molecular FormulaC12H24N2O3
Molecular Weight244.33 g/mol
Exact Mass244.18
IUPAC NameN-(3-hydroxy-2,3-dimethylbutan-2-yl)-4-(methylamino)oxolane-3-carboxamide
SMILESCNC1COCC1C(=O)NC(C)(C)C(C)(C)O
InChIInChI=1S/C12H24N2O3/c1-11(2,12(3,4)16)14-10(15)8-6-17-7-9(8)13-5/h8-9,13,16H,6-7H2,1-5H3,(H,14,15)
InChIKeyNTCHZSAJIPNPDN-UHFFFAOYSA-N
XLogP-0.11
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.33
LogP ≤ 5-0.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]-4-(methylamino)oxolane-3-carboxamide
CID 114010610
N-[3-(hydroxymethyl)pentan-3-yl]-4-(methylamino)oxolane-3-carboxamide
CID 66265856
4-(methylamino)-N-piperidin-1-yloxolane-3-carboxamide
CID 83021088
3,3-dimethyl-2-[[4-(methylamino)oxolane-3-carbonyl]amino]butanoic acid
CID 66266624
N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-methylcyclopropane-1-carboxamide
CID 103895464
N-(5-hydroxy-2,2-dimethylpentyl)-4-(methylamino)oxolane-3-carboxamide
CID 106148282
1-[4-(methylamino)oxolan-3-yl]prop-2-en-1-one
CID 116561380
N-(2,3-dimethylbutyl)-4-(methylamino)oxolane-3-carboxamide
CID 66267245
N-(1-hydroxy-3-methylbutan-2-yl)-4-(methylamino)oxolane-3-carboxamide
CID 79249718
N-hexyl-4-(methylamino)oxolane-3-carboxamide
CID 66266175
(2R)-3-hydroxy-2-[[4-(methylamino)oxolane-3-carbonyl]amino]propanoic acid
CID 80750308
(4-hydroxypiperidin-1-yl)-[4-(methylamino)oxolan-3-yl]methanone
CID 66267148

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxy-2,3-dimethylbutan-2-yl)-4-(methylamino)oxolane-3-carboxamide?
The IUPAC name of N-(3-hydroxy-2,3-dimethylbutan-2-yl)-4-(methylamino)oxolane-3-carboxamide (CID 114155776) is N-(3-hydroxy-2,3-dimethylbutan-2-yl)-4-(methylamino)oxolane-3-carboxamide.
What is the SMILES notation for N-(3-hydroxy-2,3-dimethylbutan-2-yl)-4-(methylamino)oxolane-3-carboxamide?
The canonical SMILES for N-(3-hydroxy-2,3-dimethylbutan-2-yl)-4-(methylamino)oxolane-3-carboxamide is CNC1COCC1C(=O)NC(C)(C)C(C)(C)O.
What is the InChIKey of N-(3-hydroxy-2,3-dimethylbutan-2-yl)-4-(methylamino)oxolane-3-carboxamide?
The InChIKey is NTCHZSAJIPNPDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O3/c1-11(2,12(3,4)16)14-10(15)8-6-17-7-9(8)13-5/h8-9,13,16H,6-7H2,1-5H3,(H,14,15).
What are the key properties of N-(3-hydroxy-2,3-dimethylbutan-2-yl)-4-(methylamino)oxolane-3-carboxamide?
N-(3-hydroxy-2,3-dimethylbutan-2-yl)-4-(methylamino)oxolane-3-carboxamide has a molecular weight of 244.33 g/mol, XLogP of -0.11, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxy-2,3-dimethylbutan-2-yl)-4-(methylamino)oxolane-3-carboxamide is sourced from PubChem (CID 114155776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).