2-[1-(2-morpholin-4-yl-2-oxoethyl)tetrazol-5-yl]acetic acid

C9H13N5O4 — CID 84758764

IUPAC2-[1-(2-morpholin-4-yl-2-oxoethyl)tetrazol-5-yl]acetic acid
SMILESO=C(O)Cc1nnnn1CC(=O)N1CCOCC1
InChIInChI=1S/C9H13N5O4/c15-8(13-1-3-18-4-2-13)6-14-7(5-9(16)17)10-11-12-14/h1-6H2,(H,16,17)
InChIKeyPRWRZBWPRSUHJP-UHFFFAOYSA-N
MW255.23 g/mol
LogP-1.84
Rot. Bonds4

About 2-[1-(2-morpholin-4-yl-2-oxoethyl)tetrazol-5-yl]acetic acid

2-[1-(2-morpholin-4-yl-2-oxoethyl)tetrazol-5-yl]acetic acid (PubChem CID 84758764) has the molecular formula C9H13N5O4 and a molecular weight of 255.23 g/mol. Its IUPAC name is 2-[1-(2-morpholin-4-yl-2-oxoethyl)tetrazol-5-yl]acetic acid.

Molecular Properties

Compound Name2-[1-(2-morpholin-4-yl-2-oxoethyl)tetrazol-5-yl]acetic acid
PubChem CID84758764
Molecular FormulaC9H13N5O4
Molecular Weight255.23 g/mol
Exact Mass255.10
IUPAC Name2-[1-(2-morpholin-4-yl-2-oxoethyl)tetrazol-5-yl]acetic acid
SMILESO=C(O)Cc1nnnn1CC(=O)N1CCOCC1
InChIInChI=1S/C9H13N5O4/c15-8(13-1-3-18-4-2-13)6-14-7(5-9(16)17)10-11-12-14/h1-6H2,(H,16,17)
InChIKeyPRWRZBWPRSUHJP-UHFFFAOYSA-N
XLogP-1.84
TPSA110.44 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.23
LogP ≤ 5-1.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

2-[3-(2-morpholin-4-yl-2-oxoethyl)-4-oxophthalazin-1-yl]acetic acid
CID 153189612
2-(1-ethyltetrazol-5-yl)sulfanyl-1-morpholin-4-ylethanone
CID 649256
2-(3,5-dichloro-1,2,4-triazol-1-yl)-1-morpholin-4-ylethanone
CID 648485
2-(1-nonyltetrazol-5-yl)acetic acid
CID 162532459
2-[5-(pyrrolidin-1-ylmethyl)tetrazol-1-yl]acetic acid;hydrochloride
CID 75357903
ethyl 4-[2-[5-(pyrrolidin-1-ylmethyl)tetrazol-1-yl]acetyl]piperazine-1-carboxylate
CID 42401938
2-[1-[2-(3,4-dimethylphenyl)-2-oxoethyl]tetrazol-5-yl]acetic acid
CID 84758817
5-methyl-2-(2-morpholin-4-yl-2-oxoethyl)-3-oxopyridazine-4-carboxylic acid
CID 175313059
6-cyclopropyl-2-(2-morpholin-4-yl-2-oxoethyl)pyridazin-3-one
CID 122160609
2-[4-(2-hydroxyethyl)triazol-1-yl]-1-morpholin-4-ylethanone
CID 62399432
1-(azetidin-1-yl)-2-(5-tert-butyltetrazol-1-yl)ethanone
CID 146125913
3-[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-1-yl]propanoic acid
CID 43396296

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-morpholin-4-yl-2-oxoethyl)tetrazol-5-yl]acetic acid?
The IUPAC name of 2-[1-(2-morpholin-4-yl-2-oxoethyl)tetrazol-5-yl]acetic acid (CID 84758764) is 2-[1-(2-morpholin-4-yl-2-oxoethyl)tetrazol-5-yl]acetic acid.
What is the SMILES notation for 2-[1-(2-morpholin-4-yl-2-oxoethyl)tetrazol-5-yl]acetic acid?
The canonical SMILES for 2-[1-(2-morpholin-4-yl-2-oxoethyl)tetrazol-5-yl]acetic acid is O=C(O)Cc1nnnn1CC(=O)N1CCOCC1.
What is the InChIKey of 2-[1-(2-morpholin-4-yl-2-oxoethyl)tetrazol-5-yl]acetic acid?
The InChIKey is PRWRZBWPRSUHJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N5O4/c15-8(13-1-3-18-4-2-13)6-14-7(5-9(16)17)10-11-12-14/h1-6H2,(H,16,17).
What are the key properties of 2-[1-(2-morpholin-4-yl-2-oxoethyl)tetrazol-5-yl]acetic acid?
2-[1-(2-morpholin-4-yl-2-oxoethyl)tetrazol-5-yl]acetic acid has a molecular weight of 255.23 g/mol, XLogP of -1.84, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-morpholin-4-yl-2-oxoethyl)tetrazol-5-yl]acetic acid is sourced from PubChem (CID 84758764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).