formamido pentanoate

C6H11NO3 — CID 88804872

IUPACformamido pentanoate
SMILESCCCCC(=O)ONC=O
InChIInChI=1S/C6H11NO3/c1-2-3-4-6(9)10-7-5-8/h5H,2-4H2,1H3,(H,7,8)
InChIKeyCHYUGRYJNDGOKY-UHFFFAOYSA-N
MW145.16 g/mol
LogP0.38
Rot. Bonds5

About formamido pentanoate

formamido pentanoate (PubChem CID 88804872) has the molecular formula C6H11NO3 and a molecular weight of 145.16 g/mol. Its IUPAC name is formamido pentanoate.

Molecular Properties

Compound Nameformamido pentanoate
PubChem CID88804872
Molecular FormulaC6H11NO3
Molecular Weight145.16 g/mol
Exact Mass145.07
IUPAC Nameformamido pentanoate
SMILESCCCCC(=O)ONC=O
InChIInChI=1S/C6H11NO3/c1-2-3-4-6(9)10-7-5-8/h5H,2-4H2,1H3,(H,7,8)
InChIKeyCHYUGRYJNDGOKY-UHFFFAOYSA-N
XLogP0.38
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.16
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

sodium;formamido (Z)-octadec-9-enoate;hydride
CID 175201611
sodium;formamido propanoate;hydride
CID 174830035
propylamino pentanoate;hydrochloride
CID 175097669
hydrazine;methyl pentanoate
CID 88709772
dipentanoyl hexanedioate
CID 174373362
acetamido hexanoate
CID 57050446
(prop-1-enylamino) butanoate
CID 175361993
ethylamino decanoate
CID 151278124
(cyclopentylamino) pentanoate
CID 175087443
(ethoxyamino) hexanoate
CID 175072174
(hexylamino) octanoate
CID 174754807
(dodecylamino) octanoate
CID 175102615

Frequently Asked Questions

What is the IUPAC name of formamido pentanoate?
The IUPAC name of formamido pentanoate (CID 88804872) is formamido pentanoate.
What is the SMILES notation for formamido pentanoate?
The canonical SMILES for formamido pentanoate is CCCCC(=O)ONC=O.
What is the InChIKey of formamido pentanoate?
The InChIKey is CHYUGRYJNDGOKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO3/c1-2-3-4-6(9)10-7-5-8/h5H,2-4H2,1H3,(H,7,8).
What are the key properties of formamido pentanoate?
formamido pentanoate has a molecular weight of 145.16 g/mol, XLogP of 0.38, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for formamido pentanoate is sourced from PubChem (CID 88804872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).