2-amino-5-methoxy-N-(3-methoxypropyl)pentanamide

C10H22N2O3 — CID 81081158

IUPAC2-amino-5-methoxy-N-(3-methoxypropyl)pentanamide
SMILESCOCCCNC(=O)C(N)CCCOC
InChIInChI=1S/C10H22N2O3/c1-14-7-3-5-9(11)10(13)12-6-4-8-15-2/h9H,3-8,11H2,1-2H3,(H,12,13)
InChIKeyKRPRACRJLJPEQX-UHFFFAOYSA-N
MW218.30 g/mol
LogP-0.11
Rot. Bonds9

About 2-amino-5-methoxy-N-(3-methoxypropyl)pentanamide

2-amino-5-methoxy-N-(3-methoxypropyl)pentanamide (PubChem CID 81081158) has the molecular formula C10H22N2O3 and a molecular weight of 218.30 g/mol. Its IUPAC name is 2-amino-5-methoxy-N-(3-methoxypropyl)pentanamide.

Molecular Properties

Compound Name2-amino-5-methoxy-N-(3-methoxypropyl)pentanamide
PubChem CID81081158
Molecular FormulaC10H22N2O3
Molecular Weight218.30 g/mol
Exact Mass218.16
IUPAC Name2-amino-5-methoxy-N-(3-methoxypropyl)pentanamide
SMILESCOCCCNC(=O)C(N)CCCOC
InChIInChI=1S/C10H22N2O3/c1-14-7-3-5-9(11)10(13)12-6-4-8-15-2/h9H,3-8,11H2,1-2H3,(H,12,13)
InChIKeyKRPRACRJLJPEQX-UHFFFAOYSA-N
XLogP-0.11
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 5-0.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-amino-5-methoxy-N-(4-methylpentyl)pentanamide
CID 81089350
2-amino-5-methoxy-N-propylpentanamide
CID 81082005
2-amino-5-methoxy-N-(6-methylsulfanylhexyl)pentanamide
CID 114125405
2-amino-N-(cyanomethyl)-5-methoxypentanamide
CID 81089065
2-amino-N-[2-[di(propan-2-yl)amino]ethyl]-5-methoxypentanamide
CID 81081228
2-amino-N-(3-aminopropyl)-4-methoxybutanamide
CID 62477474
2-amino-N-(3-methoxypropyl)-4-methylpentanamide
CID 22170060
2-amino-4-methoxy-N-(3-propan-2-yloxypropyl)butanamide
CID 62476611
3-[(2-amino-5-methoxypentanoyl)amino]-2-hydroxypropanoic acid
CID 81102712
2-amino-N-[4-(2-methoxyethoxy)butyl]hexanamide
CID 115753308
2-amino-5-methoxy-N-(2-methyl-2-methylsulfonylpropyl)pentanamide
CID 81102476
2-amino-N-(2-hydroxyethyl)-4-methoxybutanamide
CID 62472987

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-methoxy-N-(3-methoxypropyl)pentanamide?
The IUPAC name of 2-amino-5-methoxy-N-(3-methoxypropyl)pentanamide (CID 81081158) is 2-amino-5-methoxy-N-(3-methoxypropyl)pentanamide.
What is the SMILES notation for 2-amino-5-methoxy-N-(3-methoxypropyl)pentanamide?
The canonical SMILES for 2-amino-5-methoxy-N-(3-methoxypropyl)pentanamide is COCCCNC(=O)C(N)CCCOC.
What is the InChIKey of 2-amino-5-methoxy-N-(3-methoxypropyl)pentanamide?
The InChIKey is KRPRACRJLJPEQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O3/c1-14-7-3-5-9(11)10(13)12-6-4-8-15-2/h9H,3-8,11H2,1-2H3,(H,12,13).
What are the key properties of 2-amino-5-methoxy-N-(3-methoxypropyl)pentanamide?
2-amino-5-methoxy-N-(3-methoxypropyl)pentanamide has a molecular weight of 218.30 g/mol, XLogP of -0.11, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-methoxy-N-(3-methoxypropyl)pentanamide is sourced from PubChem (CID 81081158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).