N-[3-methyl-3-[3-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]pentoxy]pentyl]-2-[(2-methylpropan-2-yl)oxy]acetamide

C23H46N2O5 — CID 170265691

IUPACN-[3-methyl-3-[3-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]pentoxy]pentyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
SMILESCCC(CCOC(C)(CC)CCNC(=O)COC(C)(C)C)NC(=O)COC(C)(C)C
InChIInChI=1S/C23H46N2O5/c1-10-18(25-20(27)17-30-22(6,7)8)12-15-28-23(9,11-2)13-14-24-19(26)16-29-21(3,4)5/h18H,10-17H2,1-9H3,(H,24,26)(H,25,27)
InChIKeyFIPXYWYRFBRJLE-UHFFFAOYSA-N
MW430.63 g/mol
LogP3.59
Rot. Bonds14

About N-[3-methyl-3-[3-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]pentoxy]pentyl]-2-[(2-methylpropan-2-yl)oxy]acetamide

N-[3-methyl-3-[3-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]pentoxy]pentyl]-2-[(2-methylpropan-2-yl)oxy]acetamide (PubChem CID 170265691) has the molecular formula C23H46N2O5 and a molecular weight of 430.63 g/mol. Its IUPAC name is N-[3-methyl-3-[3-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]pentoxy]pentyl]-2-[(2-methylpropan-2-yl)oxy]acetamide.

Molecular Properties

Compound NameN-[3-methyl-3-[3-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]pentoxy]pentyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
PubChem CID170265691
Molecular FormulaC23H46N2O5
Molecular Weight430.63 g/mol
Exact Mass430.34
IUPAC NameN-[3-methyl-3-[3-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]pentoxy]pentyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
SMILESCCC(CCOC(C)(CC)CCNC(=O)COC(C)(C)C)NC(=O)COC(C)(C)C
InChIInChI=1S/C23H46N2O5/c1-10-18(25-20(27)17-30-22(6,7)8)12-15-28-23(9,11-2)13-14-24-19(26)16-29-21(3,4)5/h18H,10-17H2,1-9H3,(H,24,26)(H,25,27)
InChIKeyFIPXYWYRFBRJLE-UHFFFAOYSA-N
XLogP3.59
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds14
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.63
LogP ≤ 53.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1-hydroxybutan-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112603120
tert-butyl N-[3-methyl-3-(3-methylbutoxy)pentyl]carbamate
CID 118409061
2-[(2-methylpropan-2-yl)oxy]-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide
CID 134170006
N-(4-hydroxypentyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 107300430
N-(1-amino-1-sulfanylidenepentan-3-yl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112602720
N-[3-methyl-3-(3-methylbutoxy)butyl]propanamide
CID 147929425
N-(1-aminohexan-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112603533
N-hexyl-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112605068
5-ethoxy-N-[3-methyl-3-(3,3,4-trimethylpentoxy)pentyl]pentanamide
CID 170703404
N-(2-aminobutyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112603389
N-(4-methoxybutyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112605413
2-chloro-N-[(2S)-1-[(2-methylpropan-2-yl)oxy]butan-2-yl]acetamide
CID 167788378

Frequently Asked Questions

What is the IUPAC name of N-[3-methyl-3-[3-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]pentoxy]pentyl]-2-[(2-methylpropan-2-yl)oxy]acetamide?
The IUPAC name of N-[3-methyl-3-[3-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]pentoxy]pentyl]-2-[(2-methylpropan-2-yl)oxy]acetamide (CID 170265691) is N-[3-methyl-3-[3-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]pentoxy]pentyl]-2-[(2-methylpropan-2-yl)oxy]acetamide.
What is the SMILES notation for N-[3-methyl-3-[3-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]pentoxy]pentyl]-2-[(2-methylpropan-2-yl)oxy]acetamide?
The canonical SMILES for N-[3-methyl-3-[3-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]pentoxy]pentyl]-2-[(2-methylpropan-2-yl)oxy]acetamide is CCC(CCOC(C)(CC)CCNC(=O)COC(C)(C)C)NC(=O)COC(C)(C)C.
What is the InChIKey of N-[3-methyl-3-[3-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]pentoxy]pentyl]-2-[(2-methylpropan-2-yl)oxy]acetamide?
The InChIKey is FIPXYWYRFBRJLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H46N2O5/c1-10-18(25-20(27)17-30-22(6,7)8)12-15-28-23(9,11-2)13-14-24-19(26)16-29-21(3,4)5/h18H,10-17H2,1-9H3,(H,24,26)(H,25,27).
What are the key properties of N-[3-methyl-3-[3-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]pentoxy]pentyl]-2-[(2-methylpropan-2-yl)oxy]acetamide?
N-[3-methyl-3-[3-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]pentoxy]pentyl]-2-[(2-methylpropan-2-yl)oxy]acetamide has a molecular weight of 430.63 g/mol, XLogP of 3.59, 14 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-methyl-3-[3-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]pentoxy]pentyl]-2-[(2-methylpropan-2-yl)oxy]acetamide is sourced from PubChem (CID 170265691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).