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

C11H21N5O — CID 13103366

IUPACN,N-diethyl-5-(5-methyltetrazol-1-yl)pentanamide
SMILESCCN(CC)C(=O)CCCCn1nnnc1C
InChIInChI=1S/C11H21N5O/c1-4-15(5-2)11(17)8-6-7-9-16-10(3)12-13-14-16/h4-9H2,1-3H3
InChIKeyLJKHZSKGUQBGMO-UHFFFAOYSA-N
MW239.32 g/mol
LogP1.02
Rot. Bonds7

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

N,N-diethyl-5-(5-methyltetrazol-1-yl)pentanamide (PubChem CID 13103366) has the molecular formula C11H21N5O and a molecular weight of 239.32 g/mol. Its IUPAC name is N,N-diethyl-5-(5-methyltetrazol-1-yl)pentanamide.

Molecular Properties

Compound NameN,N-diethyl-5-(5-methyltetrazol-1-yl)pentanamide
PubChem CID13103366
Molecular FormulaC11H21N5O
Molecular Weight239.32 g/mol
Exact Mass239.17
IUPAC NameN,N-diethyl-5-(5-methyltetrazol-1-yl)pentanamide
SMILESCCN(CC)C(=O)CCCCn1nnnc1C
InChIInChI=1S/C11H21N5O/c1-4-15(5-2)11(17)8-6-7-9-16-10(3)12-13-14-16/h4-9H2,1-3H3
InChIKeyLJKHZSKGUQBGMO-UHFFFAOYSA-N
XLogP1.02
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 ≤ 51.02
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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Related Compounds

1H-Tetrazole-1-butanamide, N,N-diethyl-5-methyl-
CID 3061971
1H-Tetrazole-1-butanamide, N-cyclohexyl-N-ethyl-5-methyl-
CID 3061972
N-butyl-4-(5-methyltetrazol-1-yl)butanamide
CID 13103341
4-(5-methyltetrazol-1-yl)-N,N-dipropylbutanamide
CID 13103342
N,N-dibutyl-4-(5-methyltetrazol-1-yl)butanamide
CID 13103343
N-hexyl-4-(5-methyltetrazol-1-yl)butanamide
CID 13103344
4-(5-Methyltetrazol-1-yl)-1-piperidin-1-ylbutan-1-one
CID 13103358
4-(5-butyltetrazol-1-yl)-N,N-diethylbutanamide
CID 13103360
N,N-dimethyl-4-(5-methyltetrazol-1-yl)butanamide
CID 13103367
1-(4-Methylpiperazin-1-yl)-4-(5-methyltetrazol-1-yl)butan-1-one
CID 13138442
N,N-diethyl-5-(1-methyl-1,2,3,4-tetrazol-5-yl)valeramide
CID 13142190
N-ethyl-N-cyclohexyl-5-(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)valeramide
CID 13203397

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-5-(5-methyltetrazol-1-yl)pentanamide?
The IUPAC name of N,N-diethyl-5-(5-methyltetrazol-1-yl)pentanamide (CID 13103366) is N,N-diethyl-5-(5-methyltetrazol-1-yl)pentanamide.
What is the SMILES notation for N,N-diethyl-5-(5-methyltetrazol-1-yl)pentanamide?
The canonical SMILES for N,N-diethyl-5-(5-methyltetrazol-1-yl)pentanamide is CCN(CC)C(=O)CCCCn1nnnc1C.
What is the InChIKey of N,N-diethyl-5-(5-methyltetrazol-1-yl)pentanamide?
The InChIKey is LJKHZSKGUQBGMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N5O/c1-4-15(5-2)11(17)8-6-7-9-16-10(3)12-13-14-16/h4-9H2,1-3H3.
What are the key properties of N,N-diethyl-5-(5-methyltetrazol-1-yl)pentanamide?
N,N-diethyl-5-(5-methyltetrazol-1-yl)pentanamide has a molecular weight of 239.32 g/mol, XLogP of 1.02, 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-(5-methyltetrazol-1-yl)pentanamide is sourced from PubChem (CID 13103366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).