N-[[2-[5-(2-aminoethyl)tetrazol-1-yl]acetyl]amino]formamide

C6H11N7O2 — CID 145309316

IUPACN-[[2-[5-(2-aminoethyl)tetrazol-1-yl]acetyl]amino]formamide
SMILESNCCc1nnnn1CC(=O)NNC=O
InChIInChI=1S/C6H11N7O2/c7-2-1-5-9-11-12-13(5)3-6(15)10-8-4-14/h4H,1-3,7H2,(H,8,14)(H,10,15)
InChIKeyGCOAOQXYJZHPBZ-UHFFFAOYSA-N
MW213.20 g/mol
LogP-3.05
Rot. Bonds6

About N-[[2-[5-(2-aminoethyl)tetrazol-1-yl]acetyl]amino]formamide

N-[[2-[5-(2-aminoethyl)tetrazol-1-yl]acetyl]amino]formamide (PubChem CID 145309316) has the molecular formula C6H11N7O2 and a molecular weight of 213.20 g/mol. Its IUPAC name is N-[[2-[5-(2-aminoethyl)tetrazol-1-yl]acetyl]amino]formamide.

Molecular Properties

Compound NameN-[[2-[5-(2-aminoethyl)tetrazol-1-yl]acetyl]amino]formamide
PubChem CID145309316
Molecular FormulaC6H11N7O2
Molecular Weight213.20 g/mol
Exact Mass213.10
IUPAC NameN-[[2-[5-(2-aminoethyl)tetrazol-1-yl]acetyl]amino]formamide
SMILESNCCc1nnnn1CC(=O)NNC=O
InChIInChI=1S/C6H11N7O2/c7-2-1-5-9-11-12-13(5)3-6(15)10-8-4-14/h4H,1-3,7H2,(H,8,14)(H,10,15)
InChIKeyGCOAOQXYJZHPBZ-UHFFFAOYSA-N
XLogP-3.05
TPSA127.82 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.20
LogP ≤ 5-3.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-[1-[2-(dimethylamino)ethyl]tetrazol-5-yl]ethanamine
CID 82228376
benzyl 5-(2-aminoethyl)tetrazole-1-carboxylate
CID 87871791
3-[1-[2-oxo-2-(pyridin-2-ylamino)ethyl]tetrazol-5-yl]propanoic acid
CID 84758880
3-[1-[2-(4-methylanilino)-2-oxoethyl]tetrazol-5-yl]propanoic acid
CID 84758832
2-[5-(2-methoxyethyl)tetrazol-1-yl]acetic acid
CID 84759092
2-[5-[(4-bromophenyl)methyl]tetrazol-1-yl]-N-prop-2-enylacetamide
CID 56790493
2-[5-(2-hydroxyethyl)tetrazol-1-yl]-N-[(2-methylcyclohexyl)carbamoyl]acetamide
CID 126802183
2-[5-(2-hydroxyethyl)tetrazol-1-yl]-N-[[(1R,2S)-2-methylcyclohexyl]carbamoyl]acetamide
CID 125419977
3-[1-(2-methylprop-2-enyl)tetrazol-5-yl]propanoic acid
CID 84758869
2-[1-(2-morpholin-4-ylethyl)tetrazol-5-yl]ethanamine
CID 82228359
N-[(4-chlorophenyl)methyl]-2-(5-ethyltetrazol-1-yl)acetamide
CID 47358220
N-methoxy-2-(5-methyltetrazol-1-yl)acetamide
CID 127012088

Frequently Asked Questions

What is the IUPAC name of N-[[2-[5-(2-aminoethyl)tetrazol-1-yl]acetyl]amino]formamide?
The IUPAC name of N-[[2-[5-(2-aminoethyl)tetrazol-1-yl]acetyl]amino]formamide (CID 145309316) is N-[[2-[5-(2-aminoethyl)tetrazol-1-yl]acetyl]amino]formamide.
What is the SMILES notation for N-[[2-[5-(2-aminoethyl)tetrazol-1-yl]acetyl]amino]formamide?
The canonical SMILES for N-[[2-[5-(2-aminoethyl)tetrazol-1-yl]acetyl]amino]formamide is NCCc1nnnn1CC(=O)NNC=O.
What is the InChIKey of N-[[2-[5-(2-aminoethyl)tetrazol-1-yl]acetyl]amino]formamide?
The InChIKey is GCOAOQXYJZHPBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N7O2/c7-2-1-5-9-11-12-13(5)3-6(15)10-8-4-14/h4H,1-3,7H2,(H,8,14)(H,10,15).
What are the key properties of N-[[2-[5-(2-aminoethyl)tetrazol-1-yl]acetyl]amino]formamide?
N-[[2-[5-(2-aminoethyl)tetrazol-1-yl]acetyl]amino]formamide has a molecular weight of 213.20 g/mol, XLogP of -3.05, 6 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-[5-(2-aminoethyl)tetrazol-1-yl]acetyl]amino]formamide is sourced from PubChem (CID 145309316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).