N-(3-amino-2-methylpropyl)-N-methyl-2-(oxan-4-yl)acetamide

C12H24N2O2 — CID 115272471

IUPACN-(3-amino-2-methylpropyl)-N-methyl-2-(oxan-4-yl)acetamide
SMILESCC(CN)CN(C)C(=O)CC1CCOCC1
InChIInChI=1S/C12H24N2O2/c1-10(8-13)9-14(2)12(15)7-11-3-5-16-6-4-11/h10-11H,3-9,13H2,1-2H3
InChIKeyVIXBACOVALYYHD-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.86
Rot. Bonds5

About N-(3-amino-2-methylpropyl)-N-methyl-2-(oxan-4-yl)acetamide

N-(3-amino-2-methylpropyl)-N-methyl-2-(oxan-4-yl)acetamide (PubChem CID 115272471) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is N-(3-amino-2-methylpropyl)-N-methyl-2-(oxan-4-yl)acetamide.

Molecular Properties

Compound NameN-(3-amino-2-methylpropyl)-N-methyl-2-(oxan-4-yl)acetamide
PubChem CID115272471
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC NameN-(3-amino-2-methylpropyl)-N-methyl-2-(oxan-4-yl)acetamide
SMILESCC(CN)CN(C)C(=O)CC1CCOCC1
InChIInChI=1S/C12H24N2O2/c1-10(8-13)9-14(2)12(15)7-11-3-5-16-6-4-11/h10-11H,3-9,13H2,1-2H3
InChIKeyVIXBACOVALYYHD-UHFFFAOYSA-N
XLogP0.86
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-amino-2-methylpropyl)-2-cycloheptyl-N-methylacetamide
CID 114456979
2-(4-aminocyclohexyl)-N-methyl-N-(oxan-4-ylmethyl)acetamide
CID 55226080
3-methyl-2-[methyl-[2-(oxan-4-yl)acetyl]amino]butanoic acid
CID 110837449
4-amino-3-methyl-1-(oxan-4-yl)butan-2-one
CID 116564545
N-(4-aminocyclohexyl)-N-methyl-2-(oxan-4-yl)acetamide
CID 115277521
N-(3-amino-2-methylpropyl)-N-methyl-3-(1-methylpyrrolidin-3-yl)propanamide
CID 115272506
oxan-4-ylmethyl 5-amino-4-methylpentanoate
CID 82687727
4-amino-3-methoxy-N-methyl-N-[2-(oxan-4-yl)ethyl]butanamide
CID 120593000
4-amino-N-methyl-N-[2-(oxan-4-yl)ethyl]pentanamide
CID 115156830
5-amino-N-methyl-N-(oxan-4-ylmethyl)hexanamide
CID 82852241
N-[4-(hydroxymethyl)cyclohexyl]-N-methyl-2-(oxan-4-yl)acetamide
CID 115277339
N-(3-amino-3-hydroxyimino-2-methylpropyl)-2-cycloheptyl-N-methylacetamide
CID 104928884

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2-methylpropyl)-N-methyl-2-(oxan-4-yl)acetamide?
The IUPAC name of N-(3-amino-2-methylpropyl)-N-methyl-2-(oxan-4-yl)acetamide (CID 115272471) is N-(3-amino-2-methylpropyl)-N-methyl-2-(oxan-4-yl)acetamide.
What is the SMILES notation for N-(3-amino-2-methylpropyl)-N-methyl-2-(oxan-4-yl)acetamide?
The canonical SMILES for N-(3-amino-2-methylpropyl)-N-methyl-2-(oxan-4-yl)acetamide is CC(CN)CN(C)C(=O)CC1CCOCC1.
What is the InChIKey of N-(3-amino-2-methylpropyl)-N-methyl-2-(oxan-4-yl)acetamide?
The InChIKey is VIXBACOVALYYHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-10(8-13)9-14(2)12(15)7-11-3-5-16-6-4-11/h10-11H,3-9,13H2,1-2H3.
What are the key properties of N-(3-amino-2-methylpropyl)-N-methyl-2-(oxan-4-yl)acetamide?
N-(3-amino-2-methylpropyl)-N-methyl-2-(oxan-4-yl)acetamide has a molecular weight of 228.34 g/mol, XLogP of 0.86, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2-methylpropyl)-N-methyl-2-(oxan-4-yl)acetamide is sourced from PubChem (CID 115272471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).