N,N-diethyl-5-(1-methyltetrazol-5-yl)pentanamide

C11H21N5O — CID 13142190

IUPACN,N-diethyl-5-(1-methyltetrazol-5-yl)pentanamide
SMILESCCN(CC)C(=O)CCCCc1nnnn1C
InChIInChI=1S/C11H21N5O/c1-4-16(5-2)11(17)9-7-6-8-10-12-13-14-15(10)3/h4-9H2,1-3H3
InChIKeyIYCUUMWBRGFUNK-UHFFFAOYSA-N
MW239.32 g/mol
LogP0.79
Rot. Bonds7

About N,N-diethyl-5-(1-methyltetrazol-5-yl)pentanamide

N,N-diethyl-5-(1-methyltetrazol-5-yl)pentanamide (PubChem CID 13142190) has the molecular formula C11H21N5O and a molecular weight of 239.32 g/mol. Its IUPAC name is N,N-diethyl-5-(1-methyltetrazol-5-yl)pentanamide.

Molecular Properties

Compound NameN,N-diethyl-5-(1-methyltetrazol-5-yl)pentanamide
PubChem CID13142190
Molecular FormulaC11H21N5O
Molecular Weight239.32 g/mol
Exact Mass239.17
IUPAC NameN,N-diethyl-5-(1-methyltetrazol-5-yl)pentanamide
SMILESCCN(CC)C(=O)CCCCc1nnnn1C
InChIInChI=1S/C11H21N5O/c1-4-16(5-2)11(17)9-7-6-8-10-12-13-14-15(10)3/h4-9H2,1-3H3
InChIKeyIYCUUMWBRGFUNK-UHFFFAOYSA-N
XLogP0.79
TPSA63.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 50.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-5-(1-methyltetrazol-5-yl)pentanamide?
The IUPAC name of N,N-diethyl-5-(1-methyltetrazol-5-yl)pentanamide (CID 13142190) is N,N-diethyl-5-(1-methyltetrazol-5-yl)pentanamide.
What is the SMILES notation for N,N-diethyl-5-(1-methyltetrazol-5-yl)pentanamide?
The canonical SMILES for N,N-diethyl-5-(1-methyltetrazol-5-yl)pentanamide is CCN(CC)C(=O)CCCCc1nnnn1C.
What is the InChIKey of N,N-diethyl-5-(1-methyltetrazol-5-yl)pentanamide?
The InChIKey is IYCUUMWBRGFUNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N5O/c1-4-16(5-2)11(17)9-7-6-8-10-12-13-14-15(10)3/h4-9H2,1-3H3.
What are the key properties of N,N-diethyl-5-(1-methyltetrazol-5-yl)pentanamide?
N,N-diethyl-5-(1-methyltetrazol-5-yl)pentanamide has a molecular weight of 239.32 g/mol, XLogP of 0.79, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-5-(1-methyltetrazol-5-yl)pentanamide is sourced from PubChem (CID 13142190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).