N-butyl-2-(2-methoxypropylamino)propanamide

C11H24N2O2 — CID 102698101

IUPACN-butyl-2-(2-methoxypropylamino)propanamide
SMILESCCCCNC(=O)C(C)NCC(C)OC
InChIInChI=1S/C11H24N2O2/c1-5-6-7-12-11(14)10(3)13-8-9(2)15-4/h9-10,13H,5-8H2,1-4H3,(H,12,14)
InChIKeyDNQSPKLQSGWJIS-UHFFFAOYSA-N
MW216.32 g/mol
LogP0.92
Rot. Bonds8

About N-butyl-2-(2-methoxypropylamino)propanamide

N-butyl-2-(2-methoxypropylamino)propanamide (PubChem CID 102698101) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is N-butyl-2-(2-methoxypropylamino)propanamide.

Molecular Properties

Compound NameN-butyl-2-(2-methoxypropylamino)propanamide
PubChem CID102698101
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC NameN-butyl-2-(2-methoxypropylamino)propanamide
SMILESCCCCNC(=O)C(C)NCC(C)OC
InChIInChI=1S/C11H24N2O2/c1-5-6-7-12-11(14)10(3)13-8-9(2)15-4/h9-10,13H,5-8H2,1-4H3,(H,12,14)
InChIKeyDNQSPKLQSGWJIS-UHFFFAOYSA-N
XLogP0.92
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-butyl-2-[(3-ethyl-2-hydroxypentyl)amino]propanamide
CID 114168386
2-(2-methoxypropylamino)-N-prop-2-enylpropanamide
CID 102697960
2-(3-methoxypropylamino)-N-pentylpropanamide
CID 43131874
N-butyl-2-[(3-hydroxy-4-methoxybutyl)amino]propanamide
CID 106246633
N-butyl-2-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]propanamide
CID 112683886
N-butyl-2-[[2-(ethylamino)-2-oxoethyl]amino]propanamide
CID 43420298
2-(2-cyclopropylpropylamino)-N-pentylpropanamide
CID 115591539
2-[[1-oxo-1-(pentylamino)propan-2-yl]amino]ethyl carbamate
CID 83210164
2-(butylamino)-N-(3-methylbutyl)propanamide
CID 43112967
N-butyl-2-[[2-(dimethylamino)-2-oxoethyl]amino]propanamide
CID 43243844
2-[[1-(butylamino)-1-oxopropan-2-yl]amino]-N-ethylpropanamide
CID 60722434
N-(2-methoxyethyl)-2-(nonylamino)propanamide
CID 115574851

Frequently Asked Questions

What is the IUPAC name of N-butyl-2-(2-methoxypropylamino)propanamide?
The IUPAC name of N-butyl-2-(2-methoxypropylamino)propanamide (CID 102698101) is N-butyl-2-(2-methoxypropylamino)propanamide.
What is the SMILES notation for N-butyl-2-(2-methoxypropylamino)propanamide?
The canonical SMILES for N-butyl-2-(2-methoxypropylamino)propanamide is CCCCNC(=O)C(C)NCC(C)OC.
What is the InChIKey of N-butyl-2-(2-methoxypropylamino)propanamide?
The InChIKey is DNQSPKLQSGWJIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-5-6-7-12-11(14)10(3)13-8-9(2)15-4/h9-10,13H,5-8H2,1-4H3,(H,12,14).
What are the key properties of N-butyl-2-(2-methoxypropylamino)propanamide?
N-butyl-2-(2-methoxypropylamino)propanamide has a molecular weight of 216.32 g/mol, XLogP of 0.92, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-2-(2-methoxypropylamino)propanamide is sourced from PubChem (CID 102698101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).