N-(2-aminopropyl)-N-methyl-2-propoxyacetamide

C9H20N2O2 — CID 107941599

IUPACN-(2-aminopropyl)-N-methyl-2-propoxyacetamide
SMILESCCCOCC(=O)N(C)CC(C)N
InChIInChI=1S/C9H20N2O2/c1-4-5-13-7-9(12)11(3)6-8(2)10/h8H,4-7,10H2,1-3H3
InChIKeyRKCFTNDSLWOKHN-UHFFFAOYSA-N
MW188.27 g/mol
LogP0.22
Rot. Bonds6

About N-(2-aminopropyl)-N-methyl-2-propoxyacetamide

N-(2-aminopropyl)-N-methyl-2-propoxyacetamide (PubChem CID 107941599) has the molecular formula C9H20N2O2 and a molecular weight of 188.27 g/mol. Its IUPAC name is N-(2-aminopropyl)-N-methyl-2-propoxyacetamide.

Molecular Properties

Compound NameN-(2-aminopropyl)-N-methyl-2-propoxyacetamide
PubChem CID107941599
Molecular FormulaC9H20N2O2
Molecular Weight188.27 g/mol
Exact Mass188.15
IUPAC NameN-(2-aminopropyl)-N-methyl-2-propoxyacetamide
SMILESCCCOCC(=O)N(C)CC(C)N
InChIInChI=1S/C9H20N2O2/c1-4-5-13-7-9(12)11(3)6-8(2)10/h8H,4-7,10H2,1-3H3
InChIKeyRKCFTNDSLWOKHN-UHFFFAOYSA-N
XLogP0.22
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

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2-[4-(2-methoxyacetyl)piperazin-1-yl]-N-propan-2-ylpropanamide
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5-(Aminomethyl)-4-methylmorpholin-3-one
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(5S)-5-(aminomethyl)-4-methylmorpholin-3-one
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(5R)-5-(aminomethyl)-4-methylmorpholin-3-one
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2-methoxy-N-[2-[methyl(propan-2-yl)amino]ethyl]propanamide
CID 71934317
2-methoxy-N-[3-[methyl(propan-2-yl)amino]propyl]propanamide
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2-butoxy-N-[2-[cyclopropyl(methyl)amino]ethyl]-N-methylacetamide
CID 86797070
N-(1-acetylazetidin-3-yl)-2-[(2-methylpropan-2-yl)oxy]acetamide
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Frequently Asked Questions

What is the IUPAC name of N-(2-aminopropyl)-N-methyl-2-propoxyacetamide?
The IUPAC name of N-(2-aminopropyl)-N-methyl-2-propoxyacetamide (CID 107941599) is N-(2-aminopropyl)-N-methyl-2-propoxyacetamide.
What is the SMILES notation for N-(2-aminopropyl)-N-methyl-2-propoxyacetamide?
The canonical SMILES for N-(2-aminopropyl)-N-methyl-2-propoxyacetamide is CCCOCC(=O)N(C)CC(C)N.
What is the InChIKey of N-(2-aminopropyl)-N-methyl-2-propoxyacetamide?
The InChIKey is RKCFTNDSLWOKHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O2/c1-4-5-13-7-9(12)11(3)6-8(2)10/h8H,4-7,10H2,1-3H3.
What are the key properties of N-(2-aminopropyl)-N-methyl-2-propoxyacetamide?
N-(2-aminopropyl)-N-methyl-2-propoxyacetamide has a molecular weight of 188.27 g/mol, XLogP of 0.22, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminopropyl)-N-methyl-2-propoxyacetamide is sourced from PubChem (CID 107941599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).