N-(3-amino-4-methylpentyl)-2-methoxy-N-methylpropanamide

C11H24N2O2 — CID 115737860

IUPACN-(3-amino-4-methylpentyl)-2-methoxy-N-methylpropanamide
SMILESCOC(C)C(=O)N(C)CCC(N)C(C)C
InChIInChI=1S/C11H24N2O2/c1-8(2)10(12)6-7-13(4)11(14)9(3)15-5/h8-10H,6-7,12H2,1-5H3
InChIKeyXIZDQYKMZMMYSW-UHFFFAOYSA-N
MW216.32 g/mol
LogP0.85
Rot. Bonds6

About N-(3-amino-4-methylpentyl)-2-methoxy-N-methylpropanamide

N-(3-amino-4-methylpentyl)-2-methoxy-N-methylpropanamide (PubChem CID 115737860) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is N-(3-amino-4-methylpentyl)-2-methoxy-N-methylpropanamide.

Molecular Properties

Compound NameN-(3-amino-4-methylpentyl)-2-methoxy-N-methylpropanamide
PubChem CID115737860
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC NameN-(3-amino-4-methylpentyl)-2-methoxy-N-methylpropanamide
SMILESCOC(C)C(=O)N(C)CCC(N)C(C)C
InChIInChI=1S/C11H24N2O2/c1-8(2)10(12)6-7-13(4)11(14)9(3)15-5/h8-10H,6-7,12H2,1-5H3
InChIKeyXIZDQYKMZMMYSW-UHFFFAOYSA-N
XLogP0.85
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-amino-4-methylpentyl)-N,2-dimethylbutanamide;hydrochloride
CID 119657234
N-(3-amino-4-methylpentyl)-2-(carbamoylamino)-N-methylpropanamide
CID 119658379
N-[2-(dimethylamino)ethyl]-2-methoxy-N-methylpropanamide
CID 115674309
N-(3-amino-4-methylpentyl)-3-methoxy-N-methylpropanamide
CID 81485025
N-(3-amino-4-methylpentyl)-N-methylpropanamide
CID 81484424
methyl 3-methyl-2-[methyl(3-methylbutyl)carbamoyl]butanoate
CID 115188069
N-[1-[(3-amino-4-methylpentyl)-methylamino]-1-oxopropan-2-yl]-2,2-dimethylpropanamide;hydrochloride
CID 119660529
N-(3-amino-4-methylpentyl)-3-methoxy-N,3-dimethylbutanamide
CID 103021642
4-[2-methoxypropanoyl(methyl)amino]butanoic acid
CID 115729894
N-(3-amino-4-methylpentyl)-2,2,2-trifluoro-N-methylacetamide
CID 81483985
methyl 4-[2-methoxypropanoyl(methyl)amino]butanoate
CID 115588181
N-(3-amino-4-methylpentyl)-N-methyl-2-propan-2-yloxyacetamide;hydrochloride
CID 119660231

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-4-methylpentyl)-2-methoxy-N-methylpropanamide?
The IUPAC name of N-(3-amino-4-methylpentyl)-2-methoxy-N-methylpropanamide (CID 115737860) is N-(3-amino-4-methylpentyl)-2-methoxy-N-methylpropanamide.
What is the SMILES notation for N-(3-amino-4-methylpentyl)-2-methoxy-N-methylpropanamide?
The canonical SMILES for N-(3-amino-4-methylpentyl)-2-methoxy-N-methylpropanamide is COC(C)C(=O)N(C)CCC(N)C(C)C.
What is the InChIKey of N-(3-amino-4-methylpentyl)-2-methoxy-N-methylpropanamide?
The InChIKey is XIZDQYKMZMMYSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-8(2)10(12)6-7-13(4)11(14)9(3)15-5/h8-10H,6-7,12H2,1-5H3.
What are the key properties of N-(3-amino-4-methylpentyl)-2-methoxy-N-methylpropanamide?
N-(3-amino-4-methylpentyl)-2-methoxy-N-methylpropanamide has a molecular weight of 216.32 g/mol, XLogP of 0.85, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-4-methylpentyl)-2-methoxy-N-methylpropanamide is sourced from PubChem (CID 115737860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).