5-(3,4-dihydro-2H-pyran-2-ylmethylamino)pentanamide

C11H20N2O2 — CID 106234456

IUPAC5-(3,4-dihydro-2H-pyran-2-ylmethylamino)pentanamide
SMILESNC(=O)CCCCNCC1CCC=CO1
InChIInChI=1S/C11H20N2O2/c12-11(14)6-1-3-7-13-9-10-5-2-4-8-15-10/h4,8,10,13H,1-3,5-7,9H2,(H2,12,14)
InChIKeyHCJXPKVJJBZCIG-UHFFFAOYSA-N
MW212.29 g/mol
LogP0.92
Rot. Bonds7

About 5-(3,4-dihydro-2H-pyran-2-ylmethylamino)pentanamide

5-(3,4-dihydro-2H-pyran-2-ylmethylamino)pentanamide (PubChem CID 106234456) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is 5-(3,4-dihydro-2H-pyran-2-ylmethylamino)pentanamide.

Molecular Properties

Compound Name5-(3,4-dihydro-2H-pyran-2-ylmethylamino)pentanamide
PubChem CID106234456
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Name5-(3,4-dihydro-2H-pyran-2-ylmethylamino)pentanamide
SMILESNC(=O)CCCCNCC1CCC=CO1
InChIInChI=1S/C11H20N2O2/c12-11(14)6-1-3-7-13-9-10-5-2-4-8-15-10/h4,8,10,13H,1-3,5-7,9H2,(H2,12,14)
InChIKeyHCJXPKVJJBZCIG-UHFFFAOYSA-N
XLogP0.92
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
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-(2-fluoroethyl)-3,4-dihydro-2H-pyran-2-carboxamide
CID 126996521
N-(3,4-dihydro-2H-pyran-2-ylmethyl)-2-fluoro-2-methylpropanamide
CID 130783856
3-(3,4-dihydro-2H-pyran-2-ylmethylamino)-N,N-diethylpropanamide
CID 62064241
4-(3,4-dihydro-2H-pyran-2-ylmethylamino)butanamide
CID 62064413
2-(3,4-dihydro-2H-pyran-2-ylmethylamino)acetamide
CID 62064697
N'-(3,4-dihydro-2H-pyran-2-ylmethyl)butane-1,4-diamine
CID 62064744
N-[2-(3,4-dihydro-2H-pyran-2-ylmethylamino)ethyl]acetamide
CID 62064884
3-(3,4-dihydro-2H-pyran-2-ylmethylamino)-N-methylpropanamide
CID 62064941
3-(3,4-dihydro-2H-pyran-2-ylmethylamino)-N,N-dimethylpropanamide
CID 62065091
3-(3,4-dihydro-2H-pyran-2-ylmethylamino)-N-propylpropanamide
CID 62065110
N-butan-2-yl-3-(3,4-dihydro-2H-pyran-2-ylmethylamino)propanamide
CID 62065283
2-(3,4-dihydro-2H-pyran-2-ylmethylamino)-N-methylacetamide
CID 62065614

Frequently Asked Questions

What is the IUPAC name of 5-(3,4-dihydro-2H-pyran-2-ylmethylamino)pentanamide?
The IUPAC name of 5-(3,4-dihydro-2H-pyran-2-ylmethylamino)pentanamide (CID 106234456) is 5-(3,4-dihydro-2H-pyran-2-ylmethylamino)pentanamide.
What is the SMILES notation for 5-(3,4-dihydro-2H-pyran-2-ylmethylamino)pentanamide?
The canonical SMILES for 5-(3,4-dihydro-2H-pyran-2-ylmethylamino)pentanamide is NC(=O)CCCCNCC1CCC=CO1.
What is the InChIKey of 5-(3,4-dihydro-2H-pyran-2-ylmethylamino)pentanamide?
The InChIKey is HCJXPKVJJBZCIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c12-11(14)6-1-3-7-13-9-10-5-2-4-8-15-10/h4,8,10,13H,1-3,5-7,9H2,(H2,12,14).
What are the key properties of 5-(3,4-dihydro-2H-pyran-2-ylmethylamino)pentanamide?
5-(3,4-dihydro-2H-pyran-2-ylmethylamino)pentanamide has a molecular weight of 212.29 g/mol, XLogP of 0.92, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,4-dihydro-2H-pyran-2-ylmethylamino)pentanamide is sourced from PubChem (CID 106234456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).