5-(oxolan-2-yl)pentanamide

C9H17NO2 — CID 67128385

IUPAC5-(oxolan-2-yl)pentanamide
SMILESNC(=O)CCCCC1CCCO1
InChIInChI=1S/C9H17NO2/c10-9(11)6-2-1-4-8-5-3-7-12-8/h8H,1-7H2,(H2,10,11)
InChIKeyVOPRLUWLQJLCCJ-UHFFFAOYSA-N
MW171.24 g/mol
LogP1.21
Rot. Bonds5

About 5-(oxolan-2-yl)pentanamide

5-(oxolan-2-yl)pentanamide (PubChem CID 67128385) has the molecular formula C9H17NO2 and a molecular weight of 171.24 g/mol. Its IUPAC name is 5-(oxolan-2-yl)pentanamide.

Molecular Properties

Compound Name5-(oxolan-2-yl)pentanamide
PubChem CID67128385
Molecular FormulaC9H17NO2
Molecular Weight171.24 g/mol
Exact Mass171.13
IUPAC Name5-(oxolan-2-yl)pentanamide
SMILESNC(=O)CCCCC1CCCO1
InChIInChI=1S/C9H17NO2/c10-9(11)6-2-1-4-8-5-3-7-12-8/h8H,1-7H2,(H2,10,11)
InChIKeyVOPRLUWLQJLCCJ-UHFFFAOYSA-N
XLogP1.21
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.24
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

5-[(2R)-oxolan-2-yl]pentanoic acid
CID 67391734
5-[2-(oxolan-2-yl)ethylamino]pentanamide
CID 106237094
7-(oxolan-2-yl)heptanoic acid
CID 174977398
ethyl 5-(oxolan-2-yl)pentanoate
CID 121220970
2-[(2S)-oxolan-2-yl]acetamide
CID 89422838
1-(oxolan-2-yl)undecan-4-one
CID 114976697
1-[4-(aminomethyl)cyclohexyl]-4-(oxolan-2-yl)butan-1-one
CID 116592511
1-chloro-7-(oxolan-2-yl)heptan-4-one
CID 66044442
2-[(2-amino-2-oxoethyl)-[3-(oxolan-2-yl)propyl]amino]acetic acid
CID 107440629
3-[(2S)-oxolan-2-yl]propyl octanoate
CID 98092335
3-[(2R)-oxolan-2-yl]propyl nonanoate
CID 98549345
1-(2-methylcyclopentyl)-4-(oxolan-2-yl)butan-1-one
CID 107187091

Frequently Asked Questions

What is the IUPAC name of 5-(oxolan-2-yl)pentanamide?
The IUPAC name of 5-(oxolan-2-yl)pentanamide (CID 67128385) is 5-(oxolan-2-yl)pentanamide.
What is the SMILES notation for 5-(oxolan-2-yl)pentanamide?
The canonical SMILES for 5-(oxolan-2-yl)pentanamide is NC(=O)CCCCC1CCCO1.
What is the InChIKey of 5-(oxolan-2-yl)pentanamide?
The InChIKey is VOPRLUWLQJLCCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO2/c10-9(11)6-2-1-4-8-5-3-7-12-8/h8H,1-7H2,(H2,10,11).
What are the key properties of 5-(oxolan-2-yl)pentanamide?
5-(oxolan-2-yl)pentanamide has a molecular weight of 171.24 g/mol, XLogP of 1.21, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(oxolan-2-yl)pentanamide is sourced from PubChem (CID 67128385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).