2-amino-2-(2-propyltetrazol-5-yl)acetic acid

C6H11N5O2 — CID 84769601

IUPAC2-amino-2-(2-propyltetrazol-5-yl)acetic acid
SMILESCCCn1nnc(C(N)C(=O)O)n1
InChIInChI=1S/C6H11N5O2/c1-2-3-11-9-5(8-10-11)4(7)6(12)13/h4H,2-3,7H2,1H3,(H,12,13)
InChIKeyVVPKJNPVSXTAGL-UHFFFAOYSA-N
MW185.19 g/mol
LogP-0.83
Rot. Bonds4

About 2-amino-2-(2-propyltetrazol-5-yl)acetic acid

2-amino-2-(2-propyltetrazol-5-yl)acetic acid (PubChem CID 84769601) has the molecular formula C6H11N5O2 and a molecular weight of 185.19 g/mol. Its IUPAC name is 2-amino-2-(2-propyltetrazol-5-yl)acetic acid.

Molecular Properties

Compound Name2-amino-2-(2-propyltetrazol-5-yl)acetic acid
PubChem CID84769601
Molecular FormulaC6H11N5O2
Molecular Weight185.19 g/mol
Exact Mass185.09
IUPAC Name2-amino-2-(2-propyltetrazol-5-yl)acetic acid
SMILESCCCn1nnc(C(N)C(=O)O)n1
InChIInChI=1S/C6H11N5O2/c1-2-3-11-9-5(8-10-11)4(7)6(12)13/h4H,2-3,7H2,1H3,(H,12,13)
InChIKeyVVPKJNPVSXTAGL-UHFFFAOYSA-N
XLogP-0.83
TPSA106.92 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.19
LogP ≤ 5-0.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

propane;1-(2-propyltetrazol-5-yl)propan-1-ol
CID 145288431
2-amino-2-(1-ethyltetrazol-5-yl)acetic acid
CID 115013824
2,2,2-trichloro-N-(2-propyltetrazol-5-yl)acetamide
CID 3330529
2-(5-propan-2-yltetrazol-2-yl)ethylazanium
CID 162510105
2-amino-2-(5-methyl-1-propylpyrazol-4-yl)acetic acid
CID 112713062
(3R)-5-oxo-1-(2-propyltetrazol-5-yl)pyrrolidine-3-carbonyl chloride
CID 94068617
5-(2-methylpropyl)-2-pentyltetrazole
CID 69030180
2-(2-ethyltetrazol-5-yl)propan-1-amine
CID 84763606
2-[5-[[6-[(2-propyltetrazol-5-yl)amino]-1,2,4,5-tetrazin-3-yl]amino]tetrazol-2-yl]ethanol
CID 130311388
ethyl 5-[5-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]tetrazol-2-yl]pentanoate
CID 126831612
4-(2-propyltetrazol-5-yl)benzaldehyde
CID 146422651
2-amino-2-(1-propylpyrazol-4-yl)acetamide
CID 103572056

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(2-propyltetrazol-5-yl)acetic acid?
The IUPAC name of 2-amino-2-(2-propyltetrazol-5-yl)acetic acid (CID 84769601) is 2-amino-2-(2-propyltetrazol-5-yl)acetic acid.
What is the SMILES notation for 2-amino-2-(2-propyltetrazol-5-yl)acetic acid?
The canonical SMILES for 2-amino-2-(2-propyltetrazol-5-yl)acetic acid is CCCn1nnc(C(N)C(=O)O)n1.
What is the InChIKey of 2-amino-2-(2-propyltetrazol-5-yl)acetic acid?
The InChIKey is VVPKJNPVSXTAGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N5O2/c1-2-3-11-9-5(8-10-11)4(7)6(12)13/h4H,2-3,7H2,1H3,(H,12,13).
What are the key properties of 2-amino-2-(2-propyltetrazol-5-yl)acetic acid?
2-amino-2-(2-propyltetrazol-5-yl)acetic acid has a molecular weight of 185.19 g/mol, XLogP of -0.83, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(2-propyltetrazol-5-yl)acetic acid is sourced from PubChem (CID 84769601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).