N-[5-(2-aminoethyl)-1H-imidazol-2-yl]formamide

C6H10N4O — CID 174669761

IUPACN-[5-(2-aminoethyl)-1H-imidazol-2-yl]formamide
SMILESNCCc1cnc(NC=O)[nH]1
InChIInChI=1S/C6H10N4O/c7-2-1-5-3-8-6(10-5)9-4-11/h3-4H,1-2,7H2,(H2,8,9,10,11)
InChIKeyKVJREWQLVDOARS-UHFFFAOYSA-N
MW154.17 g/mol
LogP-0.52
Rot. Bonds4

About N-[5-(2-aminoethyl)-1H-imidazol-2-yl]formamide

N-[5-(2-aminoethyl)-1H-imidazol-2-yl]formamide (PubChem CID 174669761) has the molecular formula C6H10N4O and a molecular weight of 154.17 g/mol. Its IUPAC name is N-[5-(2-aminoethyl)-1H-imidazol-2-yl]formamide.

Molecular Properties

Compound NameN-[5-(2-aminoethyl)-1H-imidazol-2-yl]formamide
PubChem CID174669761
Molecular FormulaC6H10N4O
Molecular Weight154.17 g/mol
Exact Mass154.09
IUPAC NameN-[5-(2-aminoethyl)-1H-imidazol-2-yl]formamide
SMILESNCCc1cnc(NC=O)[nH]1
InChIInChI=1S/C6H10N4O/c7-2-1-5-3-8-6(10-5)9-4-11/h3-4H,1-2,7H2,(H2,8,9,10,11)
InChIKeyKVJREWQLVDOARS-UHFFFAOYSA-N
XLogP-0.52
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 5-0.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[5-(2-aminoethyl)-1H-imidazol-2-yl]formamide?
The IUPAC name of N-[5-(2-aminoethyl)-1H-imidazol-2-yl]formamide (CID 174669761) is N-[5-(2-aminoethyl)-1H-imidazol-2-yl]formamide.
What is the SMILES notation for N-[5-(2-aminoethyl)-1H-imidazol-2-yl]formamide?
The canonical SMILES for N-[5-(2-aminoethyl)-1H-imidazol-2-yl]formamide is NCCc1cnc(NC=O)[nH]1.
What is the InChIKey of N-[5-(2-aminoethyl)-1H-imidazol-2-yl]formamide?
The InChIKey is KVJREWQLVDOARS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4O/c7-2-1-5-3-8-6(10-5)9-4-11/h3-4H,1-2,7H2,(H2,8,9,10,11).
What are the key properties of N-[5-(2-aminoethyl)-1H-imidazol-2-yl]formamide?
N-[5-(2-aminoethyl)-1H-imidazol-2-yl]formamide has a molecular weight of 154.17 g/mol, XLogP of -0.52, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(2-aminoethyl)-1H-imidazol-2-yl]formamide is sourced from PubChem (CID 174669761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).