N-ethyl-5-[1-(3-ethylcyclohexyl)tetrazol-5-yl]pentanamide

C16H29N5O — CID 3062259

IUPACN-ethyl-5-[1-(3-ethylcyclohexyl)tetrazol-5-yl]pentanamide
SMILESCCNC(=O)CCCCc1nnnn1C1CCCC(CC)C1
InChIInChI=1S/C16H29N5O/c1-3-13-8-7-9-14(12-13)21-15(18-19-20-21)10-5-6-11-16(22)17-4-2/h13-14H,3-12H2,1-2H3,(H,17,22)
InChIKeyVDZAMAJQDOCZHP-UHFFFAOYSA-N
MW307.44 g/mol
LogP2.66
Rot. Bonds8

About N-ethyl-5-[1-(3-ethylcyclohexyl)tetrazol-5-yl]pentanamide

N-ethyl-5-[1-(3-ethylcyclohexyl)tetrazol-5-yl]pentanamide (PubChem CID 3062259) has the molecular formula C16H29N5O and a molecular weight of 307.44 g/mol. Its IUPAC name is N-ethyl-5-[1-(3-ethylcyclohexyl)tetrazol-5-yl]pentanamide.

Molecular Properties

Compound NameN-ethyl-5-[1-(3-ethylcyclohexyl)tetrazol-5-yl]pentanamide
PubChem CID3062259
Molecular FormulaC16H29N5O
Molecular Weight307.44 g/mol
Exact Mass307.24
IUPAC NameN-ethyl-5-[1-(3-ethylcyclohexyl)tetrazol-5-yl]pentanamide
SMILESCCNC(=O)CCCCc1nnnn1C1CCCC(CC)C1
InChIInChI=1S/C16H29N5O/c1-3-13-8-7-9-14(12-13)21-15(18-19-20-21)10-5-6-11-16(22)17-4-2/h13-14H,3-12H2,1-2H3,(H,17,22)
InChIKeyVDZAMAJQDOCZHP-UHFFFAOYSA-N
XLogP2.66
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.44
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N-ethyl-5-[1-(3-ethylcyclohexyl)tetrazol-5-yl]pentanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-((1-cyclohexyl-1H-tetrazol-5-yl)methyl)isobutyramide
CID 41568266
2-methyl-N-[1-(1-methyltetrazol-5-yl)ethyl]hexanamide
CID 121521258
2-(2-methylcyclohexyl)-N-[2-(2-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)ethyl]acetamide
CID 136560299
13-Propan-2-yl-1,8,12,15,16,17-hexazabicyclo[12.3.0]heptadeca-14,16-dien-7-one
CID 135034638
N-((1-cyclohexyl-1H-tetrazol-5-yl)methyl)-3-methylbutanamide
CID 41568273
N-((1-cyclohexyl-1H-tetrazol-5-yl)methyl)-2-cyclopentylacetamide
CID 41568281
2-(5-tert-butyltetrazol-1-yl)-N-(2,3-dimethylcyclohexyl)acetamide
CID 47770860
N-cyclohexyl-N-methyl-5-[1-(4-methylcyclohexyl)tetrazol-5-yl]pentanamide
CID 21295276
4-(1-cyclohexyltetrazol-5-yl)-N-ethyl-N-(4-methylcyclohexyl)butanamide
CID 21295287
N-cyclohexyl-5-(1-cyclohexyltetrazol-5-yl)-N-(piperidin-4-ylmethyl)pentanamide
CID 21295315
N-(cyclohexylmethyl)-N-ethyl-5-(1-methyltetrazol-5-yl)pentanamide
CID 21295396
N,N-bis(cyclohexylmethyl)-5-(1-cyclohexyltetrazol-5-yl)pentanamide
CID 21295531

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-[1-(3-ethylcyclohexyl)tetrazol-5-yl]pentanamide?
The IUPAC name of N-ethyl-5-[1-(3-ethylcyclohexyl)tetrazol-5-yl]pentanamide (CID 3062259) is N-ethyl-5-[1-(3-ethylcyclohexyl)tetrazol-5-yl]pentanamide.
What is the SMILES notation for N-ethyl-5-[1-(3-ethylcyclohexyl)tetrazol-5-yl]pentanamide?
The canonical SMILES for N-ethyl-5-[1-(3-ethylcyclohexyl)tetrazol-5-yl]pentanamide is CCNC(=O)CCCCc1nnnn1C1CCCC(CC)C1.
What is the InChIKey of N-ethyl-5-[1-(3-ethylcyclohexyl)tetrazol-5-yl]pentanamide?
The InChIKey is VDZAMAJQDOCZHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N5O/c1-3-13-8-7-9-14(12-13)21-15(18-19-20-21)10-5-6-11-16(22)17-4-2/h13-14H,3-12H2,1-2H3,(H,17,22).
What are the key properties of N-ethyl-5-[1-(3-ethylcyclohexyl)tetrazol-5-yl]pentanamide?
N-ethyl-5-[1-(3-ethylcyclohexyl)tetrazol-5-yl]pentanamide has a molecular weight of 307.44 g/mol, XLogP of 2.66, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-[1-(3-ethylcyclohexyl)tetrazol-5-yl]pentanamide is sourced from PubChem (CID 3062259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).