N-[(2R)-4-methyl-2-[[2-[(2S)-oxolan-2-yl]acetyl]amino]pentyl]-2-[(2S)-oxolan-2-yl]acetamide

C18H32N2O4 — CID 95333344

IUPACN-[(2R)-4-methyl-2-[[2-[(2S)-oxolan-2-yl]acetyl]amino]pentyl]-2-[(2S)-oxolan-2-yl]acetamide
SMILESCC(C)C[C@H](CNC(=O)C[C@@H]1CCCO1)NC(=O)C[C@@H]1CCCO1
InChIInChI=1S/C18H32N2O4/c1-13(2)9-14(20-18(22)11-16-6-4-8-24-16)12-19-17(21)10-15-5-3-7-23-15/h13-16H,3-12H2,1-2H3,(H,19,21)(H,20,22)/t14-,15+,16+/m1/s1
InChIKeyILPYHKFJMOKITQ-PMPSAXMXSA-N
MW340.46 g/mol
LogP1.77
Rot. Bonds9

About N-[(2R)-4-methyl-2-[[2-[(2S)-oxolan-2-yl]acetyl]amino]pentyl]-2-[(2S)-oxolan-2-yl]acetamide

N-[(2R)-4-methyl-2-[[2-[(2S)-oxolan-2-yl]acetyl]amino]pentyl]-2-[(2S)-oxolan-2-yl]acetamide (PubChem CID 95333344) has the molecular formula C18H32N2O4 and a molecular weight of 340.46 g/mol. Its IUPAC name is N-[(2R)-4-methyl-2-[[2-[(2S)-oxolan-2-yl]acetyl]amino]pentyl]-2-[(2S)-oxolan-2-yl]acetamide.

Molecular Properties

Compound NameN-[(2R)-4-methyl-2-[[2-[(2S)-oxolan-2-yl]acetyl]amino]pentyl]-2-[(2S)-oxolan-2-yl]acetamide
PubChem CID95333344
Molecular FormulaC18H32N2O4
Molecular Weight340.46 g/mol
Exact Mass340.24
IUPAC NameN-[(2R)-4-methyl-2-[[2-[(2S)-oxolan-2-yl]acetyl]amino]pentyl]-2-[(2S)-oxolan-2-yl]acetamide
SMILESCC(C)C[C@H](CNC(=O)C[C@@H]1CCCO1)NC(=O)C[C@@H]1CCCO1
InChIInChI=1S/C18H32N2O4/c1-13(2)9-14(20-18(22)11-16-6-4-8-24-16)12-19-17(21)10-15-5-3-7-23-15/h13-16H,3-12H2,1-2H3,(H,19,21)(H,20,22)/t14-,15+,16+/m1/s1
InChIKeyILPYHKFJMOKITQ-PMPSAXMXSA-N
XLogP1.77
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.46
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-chloro-4-methylpentan-2-yl)-2-(oxolan-2-yl)acetamide
CID 114300771
N-(1-bromo-4-methylpentan-2-yl)-3-(oxolan-2-yl)propanamide
CID 114311800
(2S)-2-hydroxy-3-[[2-(oxolan-2-yl)acetyl]amino]propanoic acid
CID 107833848
N-(2-acetamidoethyl)-2-(oxolan-2-yl)acetamide
CID 110696614
2-(oxolan-2-yl)-N-prop-2-ynylacetamide
CID 60769102
N-(3-amino-3-hydroxyimino-2-methylpropyl)-2-(oxolan-2-yl)acetamide
CID 77057841
2-(oxolan-2-yl)-N-(oxolan-2-ylmethyl)acetamide
CID 110696563
N-(2-methoxyethyl)-2-(oxolan-2-yl)acetamide
CID 110696561
N-(5-bromo-4-methylpentyl)-2-(oxolan-2-yl)acetamide
CID 106157924
(2S,3S)-3-methyl-2-[[2-(oxolan-2-yl)acetyl]amino]pentanoic acid
CID 65157376
N-(1-amino-1-hydroxyiminopropan-2-yl)-2-(oxolan-2-yl)acetamide
CID 77057681
N-[2-(2-bromoethyl)pentyl]-2-(oxolan-2-yl)acetamide
CID 106118076

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-4-methyl-2-[[2-[(2S)-oxolan-2-yl]acetyl]amino]pentyl]-2-[(2S)-oxolan-2-yl]acetamide?
The IUPAC name of N-[(2R)-4-methyl-2-[[2-[(2S)-oxolan-2-yl]acetyl]amino]pentyl]-2-[(2S)-oxolan-2-yl]acetamide (CID 95333344) is N-[(2R)-4-methyl-2-[[2-[(2S)-oxolan-2-yl]acetyl]amino]pentyl]-2-[(2S)-oxolan-2-yl]acetamide.
What is the SMILES notation for N-[(2R)-4-methyl-2-[[2-[(2S)-oxolan-2-yl]acetyl]amino]pentyl]-2-[(2S)-oxolan-2-yl]acetamide?
The canonical SMILES for N-[(2R)-4-methyl-2-[[2-[(2S)-oxolan-2-yl]acetyl]amino]pentyl]-2-[(2S)-oxolan-2-yl]acetamide is CC(C)C[C@H](CNC(=O)C[C@@H]1CCCO1)NC(=O)C[C@@H]1CCCO1.
What is the InChIKey of N-[(2R)-4-methyl-2-[[2-[(2S)-oxolan-2-yl]acetyl]amino]pentyl]-2-[(2S)-oxolan-2-yl]acetamide?
The InChIKey is ILPYHKFJMOKITQ-PMPSAXMXSA-N. The full InChI is InChI=1S/C18H32N2O4/c1-13(2)9-14(20-18(22)11-16-6-4-8-24-16)12-19-17(21)10-15-5-3-7-23-15/h13-16H,3-12H2,1-2H3,(H,19,21)(H,20,22)/t14-,15+,16+/m1/s1.
What are the key properties of N-[(2R)-4-methyl-2-[[2-[(2S)-oxolan-2-yl]acetyl]amino]pentyl]-2-[(2S)-oxolan-2-yl]acetamide?
N-[(2R)-4-methyl-2-[[2-[(2S)-oxolan-2-yl]acetyl]amino]pentyl]-2-[(2S)-oxolan-2-yl]acetamide has a molecular weight of 340.46 g/mol, XLogP of 1.77, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-4-methyl-2-[[2-[(2S)-oxolan-2-yl]acetyl]amino]pentyl]-2-[(2S)-oxolan-2-yl]acetamide is sourced from PubChem (CID 95333344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).