imidazolidin-1-ylmethanamine

C4H11N3 — CID 19604042

IUPACimidazolidin-1-ylmethanamine
SMILESNCN1CCNC1
InChIInChI=1S/C4H11N3/c5-3-7-2-1-6-4-7/h6H,1-5H2
InChIKeyULDXEQHROXDLTC-UHFFFAOYSA-N
MW101.15 g/mol
LogP-1.23
Rot. Bonds1

About imidazolidin-1-ylmethanamine

imidazolidin-1-ylmethanamine (PubChem CID 19604042) has the molecular formula C4H11N3 and a molecular weight of 101.15 g/mol. Its IUPAC name is imidazolidin-1-ylmethanamine.

Molecular Properties

Compound Nameimidazolidin-1-ylmethanamine
PubChem CID19604042
Molecular FormulaC4H11N3
Molecular Weight101.15 g/mol
Exact Mass101.10
IUPAC Nameimidazolidin-1-ylmethanamine
SMILESNCN1CCNC1
InChIInChI=1S/C4H11N3/c5-3-7-2-1-6-4-7/h6H,1-5H2
InChIKeyULDXEQHROXDLTC-UHFFFAOYSA-N
XLogP-1.23
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.15
LogP ≤ 5-1.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of imidazolidin-1-ylmethanamine?
The IUPAC name of imidazolidin-1-ylmethanamine (CID 19604042) is imidazolidin-1-ylmethanamine.
What is the SMILES notation for imidazolidin-1-ylmethanamine?
The canonical SMILES for imidazolidin-1-ylmethanamine is NCN1CCNC1.
What is the InChIKey of imidazolidin-1-ylmethanamine?
The InChIKey is ULDXEQHROXDLTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11N3/c5-3-7-2-1-6-4-7/h6H,1-5H2.
What are the key properties of imidazolidin-1-ylmethanamine?
imidazolidin-1-ylmethanamine has a molecular weight of 101.15 g/mol, XLogP of -1.23, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for imidazolidin-1-ylmethanamine is sourced from PubChem (CID 19604042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).