N-(4-aminopentyl)-2-methoxypropanamide

C9H20N2O2 — CID 106122458

IUPACN-(4-aminopentyl)-2-methoxypropanamide
SMILESCOC(C)C(=O)NCCCC(C)N
InChIInChI=1S/C9H20N2O2/c1-7(10)5-4-6-11-9(12)8(2)13-3/h7-8H,4-6,10H2,1-3H3,(H,11,12)
InChIKeyMSOWZGRLINAIQL-UHFFFAOYSA-N
MW188.27 g/mol
LogP0.26
Rot. Bonds6

About N-(4-aminopentyl)-2-methoxypropanamide

N-(4-aminopentyl)-2-methoxypropanamide (PubChem CID 106122458) has the molecular formula C9H20N2O2 and a molecular weight of 188.27 g/mol. Its IUPAC name is N-(4-aminopentyl)-2-methoxypropanamide.

Molecular Properties

Compound NameN-(4-aminopentyl)-2-methoxypropanamide
PubChem CID106122458
Molecular FormulaC9H20N2O2
Molecular Weight188.27 g/mol
Exact Mass188.15
IUPAC NameN-(4-aminopentyl)-2-methoxypropanamide
SMILESCOC(C)C(=O)NCCCC(C)N
InChIInChI=1S/C9H20N2O2/c1-7(10)5-4-6-11-9(12)8(2)13-3/h7-8H,4-6,10H2,1-3H3,(H,11,12)
InChIKeyMSOWZGRLINAIQL-UHFFFAOYSA-N
XLogP0.26
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 50.26
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-(3-ethoxypropyl)-2-methoxypropanamide
CID 115588519
2-methoxy-N-(3-sulfamoylpropyl)propanamide
CID 115589849
5-(2-methoxypropanoylamino)pentanoic acid
CID 115731347
N-(4-aminopentyl)-2-ethoxyacetamide
CID 106122279
2-acetamidoethyl formate;N-(4-aminopentyl)acetamide;ethane
CID 144530873
N-(3-hydroxypentyl)-2-methoxypropanamide
CID 115703372
tert-butyl N-[(5R)-5-aminohexyl]carbamate
CID 59986272
6-amino-2-methyl-N-pentylheptanamide
CID 65292783
6-amino-N-(4-hydroxybutyl)-2-methylheptanamide
CID 106841939
[1-[2-(2-methoxypropanoylamino)ethylamino]-1-oxopropan-2-yl] acetate
CID 59722273
N-(4-aminopentyl)-3,4,4-trimethylpentanamide
CID 106122483
6-amino-2-methyl-N-propylheptanamide
CID 65292773

Frequently Asked Questions

What is the IUPAC name of N-(4-aminopentyl)-2-methoxypropanamide?
The IUPAC name of N-(4-aminopentyl)-2-methoxypropanamide (CID 106122458) is N-(4-aminopentyl)-2-methoxypropanamide.
What is the SMILES notation for N-(4-aminopentyl)-2-methoxypropanamide?
The canonical SMILES for N-(4-aminopentyl)-2-methoxypropanamide is COC(C)C(=O)NCCCC(C)N.
What is the InChIKey of N-(4-aminopentyl)-2-methoxypropanamide?
The InChIKey is MSOWZGRLINAIQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O2/c1-7(10)5-4-6-11-9(12)8(2)13-3/h7-8H,4-6,10H2,1-3H3,(H,11,12).
What are the key properties of N-(4-aminopentyl)-2-methoxypropanamide?
N-(4-aminopentyl)-2-methoxypropanamide has a molecular weight of 188.27 g/mol, XLogP of 0.26, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminopentyl)-2-methoxypropanamide is sourced from PubChem (CID 106122458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).