N-(2-methylpropyl)-N-(propan-2-yloxymethyl)acetamide

C10H21NO2 — CID 12066214

IUPACN-(2-methylpropyl)-N-(propan-2-yloxymethyl)acetamide
SMILESCC(=O)N(COC(C)C)CC(C)C
InChIInChI=1S/C10H21NO2/c1-8(2)6-11(10(5)12)7-13-9(3)4/h8-9H,6-7H2,1-5H3
InChIKeyLZVZSJHPAJAWHH-UHFFFAOYSA-N
MW187.28 g/mol
LogP1.87
Rot. Bonds5

About N-(2-methylpropyl)-N-(propan-2-yloxymethyl)acetamide

N-(2-methylpropyl)-N-(propan-2-yloxymethyl)acetamide (PubChem CID 12066214) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is N-(2-methylpropyl)-N-(propan-2-yloxymethyl)acetamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-N-(propan-2-yloxymethyl)acetamide
PubChem CID12066214
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC NameN-(2-methylpropyl)-N-(propan-2-yloxymethyl)acetamide
SMILESCC(=O)N(COC(C)C)CC(C)C
InChIInChI=1S/C10H21NO2/c1-8(2)6-11(10(5)12)7-13-9(3)4/h8-9H,6-7H2,1-5H3
InChIKeyLZVZSJHPAJAWHH-UHFFFAOYSA-N
XLogP1.87
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 51.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

Isopropyl dipropylcarbamate
CID 45119301
propan-2-yl N-ethyl-N-propylcarbamate
CID 116654150
Isobutylcarbamate, N,N-dipropyl
CID 59217983
Isobutylcarbamate, N,Np-diisobutyl
CID 59217991
ethyl N,N-bis(2-methylpropyl)carbamate
CID 4390843
N-(1-methoxybutyl)-N-(methoxymethyl)-2-methylpropanamide
CID 135011351
N,N-bis(1-ethoxy-2-methylpropyl)formamide
CID 10800407
propan-2-yl N-methyl-N-(2-methylpropyl)carbamate
CID 57562787
3-methylbutan-2-yl N,N-bis(2-methylpropyl)carbamate
CID 58096576
3-methylbutan-2-yl N,N-diethylcarbamate
CID 58096859
3-methylbutan-2-yl N,N-dibutylcarbamate
CID 58096956
3-methylbutan-2-yl N,N-dipropylcarbamate
CID 58097019

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-N-(propan-2-yloxymethyl)acetamide?
The IUPAC name of N-(2-methylpropyl)-N-(propan-2-yloxymethyl)acetamide (CID 12066214) is N-(2-methylpropyl)-N-(propan-2-yloxymethyl)acetamide.
What is the SMILES notation for N-(2-methylpropyl)-N-(propan-2-yloxymethyl)acetamide?
The canonical SMILES for N-(2-methylpropyl)-N-(propan-2-yloxymethyl)acetamide is CC(=O)N(COC(C)C)CC(C)C.
What is the InChIKey of N-(2-methylpropyl)-N-(propan-2-yloxymethyl)acetamide?
The InChIKey is LZVZSJHPAJAWHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-8(2)6-11(10(5)12)7-13-9(3)4/h8-9H,6-7H2,1-5H3.
What are the key properties of N-(2-methylpropyl)-N-(propan-2-yloxymethyl)acetamide?
N-(2-methylpropyl)-N-(propan-2-yloxymethyl)acetamide has a molecular weight of 187.28 g/mol, XLogP of 1.87, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-N-(propan-2-yloxymethyl)acetamide is sourced from PubChem (CID 12066214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).