N-(2-azidoethyl)piperidine-1-carboxamide

C8H15N5O — CID 79155293

IUPACN-(2-azidoethyl)piperidine-1-carboxamide
SMILES[N-]=[N+]=NCCNC(=O)N1CCCCC1
InChIInChI=1S/C8H15N5O/c9-12-11-5-4-10-8(14)13-6-2-1-3-7-13/h1-7H2,(H,10,14)
InChIKeySOTOESNUQHDBJP-UHFFFAOYSA-N
MW197.24 g/mol
LogP1.49
Rot. Bonds3

About N-(2-azidoethyl)piperidine-1-carboxamide

N-(2-azidoethyl)piperidine-1-carboxamide (PubChem CID 79155293) has the molecular formula C8H15N5O and a molecular weight of 197.24 g/mol. Its IUPAC name is N-(2-azidoethyl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-(2-azidoethyl)piperidine-1-carboxamide
PubChem CID79155293
Molecular FormulaC8H15N5O
Molecular Weight197.24 g/mol
Exact Mass197.13
IUPAC NameN-(2-azidoethyl)piperidine-1-carboxamide
SMILES[N-]=[N+]=NCCNC(=O)N1CCCCC1
InChIInChI=1S/C8H15N5O/c9-12-11-5-4-10-8(14)13-6-2-1-3-7-13/h1-7H2,(H,10,14)
InChIKeySOTOESNUQHDBJP-UHFFFAOYSA-N
XLogP1.49
TPSA81.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Related Compounds

N-(4-azidobutyl)piperidine-1-carboxamide
CID 106386926
N-(2-fluoroethyl)piperidine-1-carboxamide
CID 126973652
N-[(piperidine-1-carbonylamino)methyl]piperidine-1-carboxamide
CID 59031008
N-(2-acetamidoethyl)piperidine-1-carboxamide
CID 115575266
N-(3-oxo-3-piperidin-1-ylpropyl)pyrrolidine-1-carboxamide
CID 115583806
N-(3-hydroxypropyl)piperidine-1-carboxamide
CID 112725647
2-(2-azidoethylamino)-4-oxo-4-piperidin-1-ylbutanenitrile
CID 66431942
N-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrrolidine-1-carboxamide
CID 113221674
N-(6-hydroxyhexyl)piperidine-1-carboxamide
CID 103918692
N-[2-(cyclopropanecarbonylamino)ethyl]azocane-1-carboxamide
CID 71940931
N-[2-(cyclopropanecarbonylamino)ethyl]azepane-1-carboxamide
CID 113223981
N-[3-oxo-3-(propan-2-ylamino)propyl]azepane-1-carboxamide
CID 115583768

Frequently Asked Questions

What is the IUPAC name of N-(2-azidoethyl)piperidine-1-carboxamide?
The IUPAC name of N-(2-azidoethyl)piperidine-1-carboxamide (CID 79155293) is N-(2-azidoethyl)piperidine-1-carboxamide.
What is the SMILES notation for N-(2-azidoethyl)piperidine-1-carboxamide?
The canonical SMILES for N-(2-azidoethyl)piperidine-1-carboxamide is [N-]=[N+]=NCCNC(=O)N1CCCCC1.
What is the InChIKey of N-(2-azidoethyl)piperidine-1-carboxamide?
The InChIKey is SOTOESNUQHDBJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N5O/c9-12-11-5-4-10-8(14)13-6-2-1-3-7-13/h1-7H2,(H,10,14).
What are the key properties of N-(2-azidoethyl)piperidine-1-carboxamide?
N-(2-azidoethyl)piperidine-1-carboxamide has a molecular weight of 197.24 g/mol, XLogP of 1.49, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-azidoethyl)piperidine-1-carboxamide is sourced from PubChem (CID 79155293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).