2-[5-(morpholin-4-ylmethyl)tetrazol-1-yl]-N,N-bis(prop-2-enyl)acetamide

C14H22N6O2 — CID 25375640

IUPAC2-[5-(morpholin-4-ylmethyl)tetrazol-1-yl]-N,N-bis(prop-2-enyl)acetamide
SMILESC=CCN(CC=C)C(=O)Cn1nnnc1CN1CCOCC1
InChIInChI=1S/C14H22N6O2/c1-3-5-19(6-4-2)14(21)12-20-13(15-16-17-20)11-18-7-9-22-10-8-18/h3-4H,1-2,5-12H2
InChIKeyYTZDLDPALFWCSM-UHFFFAOYSA-N
MW306.37 g/mol
LogP-0.29
Rot. Bonds8

About 2-[5-(morpholin-4-ylmethyl)tetrazol-1-yl]-N,N-bis(prop-2-enyl)acetamide

2-[5-(morpholin-4-ylmethyl)tetrazol-1-yl]-N,N-bis(prop-2-enyl)acetamide (PubChem CID 25375640) has the molecular formula C14H22N6O2 and a molecular weight of 306.37 g/mol. Its IUPAC name is 2-[5-(morpholin-4-ylmethyl)tetrazol-1-yl]-N,N-bis(prop-2-enyl)acetamide.

Molecular Properties

Compound Name2-[5-(morpholin-4-ylmethyl)tetrazol-1-yl]-N,N-bis(prop-2-enyl)acetamide
PubChem CID25375640
Molecular FormulaC14H22N6O2
Molecular Weight306.37 g/mol
Exact Mass306.18
IUPAC Name2-[5-(morpholin-4-ylmethyl)tetrazol-1-yl]-N,N-bis(prop-2-enyl)acetamide
SMILESC=CCN(CC=C)C(=O)Cn1nnnc1CN1CCOCC1
InChIInChI=1S/C14H22N6O2/c1-3-5-19(6-4-2)14(21)12-20-13(15-16-17-20)11-18-7-9-22-10-8-18/h3-4H,1-2,5-12H2
InChIKeyYTZDLDPALFWCSM-UHFFFAOYSA-N
XLogP-0.29
TPSA76.38 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 5-0.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[5-(morpholin-4-ylmethyl)tetrazol-1-yl]-N,N-bis(prop-2-enyl)acetamide?
The IUPAC name of 2-[5-(morpholin-4-ylmethyl)tetrazol-1-yl]-N,N-bis(prop-2-enyl)acetamide (CID 25375640) is 2-[5-(morpholin-4-ylmethyl)tetrazol-1-yl]-N,N-bis(prop-2-enyl)acetamide.
What is the SMILES notation for 2-[5-(morpholin-4-ylmethyl)tetrazol-1-yl]-N,N-bis(prop-2-enyl)acetamide?
The canonical SMILES for 2-[5-(morpholin-4-ylmethyl)tetrazol-1-yl]-N,N-bis(prop-2-enyl)acetamide is C=CCN(CC=C)C(=O)Cn1nnnc1CN1CCOCC1.
What is the InChIKey of 2-[5-(morpholin-4-ylmethyl)tetrazol-1-yl]-N,N-bis(prop-2-enyl)acetamide?
The InChIKey is YTZDLDPALFWCSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N6O2/c1-3-5-19(6-4-2)14(21)12-20-13(15-16-17-20)11-18-7-9-22-10-8-18/h3-4H,1-2,5-12H2.
What are the key properties of 2-[5-(morpholin-4-ylmethyl)tetrazol-1-yl]-N,N-bis(prop-2-enyl)acetamide?
2-[5-(morpholin-4-ylmethyl)tetrazol-1-yl]-N,N-bis(prop-2-enyl)acetamide has a molecular weight of 306.37 g/mol, XLogP of -0.29, 8 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(morpholin-4-ylmethyl)tetrazol-1-yl]-N,N-bis(prop-2-enyl)acetamide is sourced from PubChem (CID 25375640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).