N-[2-(diethylamino)ethyl]-N-ethyl-2-[5-(morpholin-4-ylmethyl)tetrazol-1-yl]acetamide

C16H31N7O2 — CID 25395883

IUPACN-[2-(diethylamino)ethyl]-N-ethyl-2-[5-(morpholin-4-ylmethyl)tetrazol-1-yl]acetamide
SMILESCCN(CC)CCN(CC)C(=O)Cn1nnnc1CN1CCOCC1
InChIInChI=1S/C16H31N7O2/c1-4-20(5-2)7-8-22(6-3)16(24)14-23-15(17-18-19-23)13-21-9-11-25-12-10-21/h4-14H2,1-3H3
InChIKeyFVAOJRPHFGYNAX-UHFFFAOYSA-N
MW353.47 g/mol
LogP-0.30
Rot. Bonds10

About N-[2-(diethylamino)ethyl]-N-ethyl-2-[5-(morpholin-4-ylmethyl)tetrazol-1-yl]acetamide

N-[2-(diethylamino)ethyl]-N-ethyl-2-[5-(morpholin-4-ylmethyl)tetrazol-1-yl]acetamide (PubChem CID 25395883) has the molecular formula C16H31N7O2 and a molecular weight of 353.47 g/mol. Its IUPAC name is N-[2-(diethylamino)ethyl]-N-ethyl-2-[5-(morpholin-4-ylmethyl)tetrazol-1-yl]acetamide.

Molecular Properties

Compound NameN-[2-(diethylamino)ethyl]-N-ethyl-2-[5-(morpholin-4-ylmethyl)tetrazol-1-yl]acetamide
PubChem CID25395883
Molecular FormulaC16H31N7O2
Molecular Weight353.47 g/mol
Exact Mass353.25
IUPAC NameN-[2-(diethylamino)ethyl]-N-ethyl-2-[5-(morpholin-4-ylmethyl)tetrazol-1-yl]acetamide
SMILESCCN(CC)CCN(CC)C(=O)Cn1nnnc1CN1CCOCC1
InChIInChI=1S/C16H31N7O2/c1-4-20(5-2)7-8-22(6-3)16(24)14-23-15(17-18-19-23)13-21-9-11-25-12-10-21/h4-14H2,1-3H3
InChIKeyFVAOJRPHFGYNAX-UHFFFAOYSA-N
XLogP-0.30
TPSA79.62 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds10
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.47
LogP ≤ 5-0.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

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Related Compounds

4-({1-[2-(4-methyl-1-piperidinyl)-2-oxoethyl]-1H-tetrazol-5-yl}methyl)morpholine
CID 24790701
4-[1-(2-Methoxy-ethyl)-1H-tetrazol-5-ylmethyl]-morpholine
CID 6602548
N,N-diethyl-1-{3-[5-(4-morpholinylmethyl)-1H-tetrazol-1-yl]propanoyl}-3-pyrrolidinamine
CID 24791608
4-[[1-(2-Methoxyethyl)tetrazol-5-yl]methyl]morpholine
CID 654379
1-[(5-{[(2R*,6S*)-2,6-dimethyl-4-morpholinyl]methyl}-1H-tetrazol-1-yl)acetyl]azocane
CID 25304171
N,N-diallyl-2-[5-(4-morpholinylmethyl)-1H-tetrazol-1-yl]acetamide
CID 25375640
ethyl 4-[(5-{[isopropyl(methyl)amino]methyl}-1H-tetrazol-1-yl)acetyl]-1-piperazinecarboxylate
CID 42566349
N-methyl-2-[5-(4-morpholinylmethyl)-1H-tetrazol-1-yl]-N-[2-(1-piperidinyl)ethyl]acetamide
CID 25293367
2-[5-(azepan-1-ylmethyl)tetrazol-1-yl]-N-methyl-N-(3-morpholin-4-ylpropyl)acetamide
CID 25365316
2-[5-(Azepan-1-ylmethyl)tetrazol-1-yl]-1-morpholin-4-ylethanone
CID 25448663
N-[(1-{2-[4-(2-methoxyethyl)-1-piperazinyl]-2-oxoethyl}-1H-tetrazol-5-yl)methyl]-N-methyl-2-propanamine
CID 26333201
2-(5-{[(2R*,6S*)-2,6-dimethyl-4-morpholinyl]methyl}-1H-tetrazol-1-yl)-N-(2-methoxy-2-methylpropyl)acetamide
CID 28346167

Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)ethyl]-N-ethyl-2-[5-(morpholin-4-ylmethyl)tetrazol-1-yl]acetamide?
The IUPAC name of N-[2-(diethylamino)ethyl]-N-ethyl-2-[5-(morpholin-4-ylmethyl)tetrazol-1-yl]acetamide (CID 25395883) is N-[2-(diethylamino)ethyl]-N-ethyl-2-[5-(morpholin-4-ylmethyl)tetrazol-1-yl]acetamide.
What is the SMILES notation for N-[2-(diethylamino)ethyl]-N-ethyl-2-[5-(morpholin-4-ylmethyl)tetrazol-1-yl]acetamide?
The canonical SMILES for N-[2-(diethylamino)ethyl]-N-ethyl-2-[5-(morpholin-4-ylmethyl)tetrazol-1-yl]acetamide is CCN(CC)CCN(CC)C(=O)Cn1nnnc1CN1CCOCC1.
What is the InChIKey of N-[2-(diethylamino)ethyl]-N-ethyl-2-[5-(morpholin-4-ylmethyl)tetrazol-1-yl]acetamide?
The InChIKey is FVAOJRPHFGYNAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N7O2/c1-4-20(5-2)7-8-22(6-3)16(24)14-23-15(17-18-19-23)13-21-9-11-25-12-10-21/h4-14H2,1-3H3.
What are the key properties of N-[2-(diethylamino)ethyl]-N-ethyl-2-[5-(morpholin-4-ylmethyl)tetrazol-1-yl]acetamide?
N-[2-(diethylamino)ethyl]-N-ethyl-2-[5-(morpholin-4-ylmethyl)tetrazol-1-yl]acetamide has a molecular weight of 353.47 g/mol, XLogP of -0.30, 10 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)ethyl]-N-ethyl-2-[5-(morpholin-4-ylmethyl)tetrazol-1-yl]acetamide is sourced from PubChem (CID 25395883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).