amino-(prop-2-enylamino)methanol

C4H10N2O — CID 126627121

IUPACamino-(prop-2-enylamino)methanol
SMILESC=CCNC(N)O
InChIInChI=1S/C4H10N2O/c1-2-3-6-4(5)7/h2,4,6-7H,1,3,5H2
InChIKeyDVDKOHGGRSQTIS-UHFFFAOYSA-N
MW102.14 g/mol
LogP-1.00
Rot. Bonds3

About amino-(prop-2-enylamino)methanol

amino-(prop-2-enylamino)methanol (PubChem CID 126627121) has the molecular formula C4H10N2O and a molecular weight of 102.14 g/mol. Its IUPAC name is amino-(prop-2-enylamino)methanol.

Molecular Properties

Compound Nameamino-(prop-2-enylamino)methanol
PubChem CID126627121
Molecular FormulaC4H10N2O
Molecular Weight102.14 g/mol
Exact Mass102.08
IUPAC Nameamino-(prop-2-enylamino)methanol
SMILESC=CCNC(N)O
InChIInChI=1S/C4H10N2O/c1-2-3-6-4(5)7/h2,4,6-7H,1,3,5H2
InChIKeyDVDKOHGGRSQTIS-UHFFFAOYSA-N
XLogP-1.00
TPSA58.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500102.14
LogP ≤ 5-1.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of amino-(prop-2-enylamino)methanol?
The IUPAC name of amino-(prop-2-enylamino)methanol (CID 126627121) is amino-(prop-2-enylamino)methanol.
What is the SMILES notation for amino-(prop-2-enylamino)methanol?
The canonical SMILES for amino-(prop-2-enylamino)methanol is C=CCNC(N)O.
What is the InChIKey of amino-(prop-2-enylamino)methanol?
The InChIKey is DVDKOHGGRSQTIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N2O/c1-2-3-6-4(5)7/h2,4,6-7H,1,3,5H2.
What are the key properties of amino-(prop-2-enylamino)methanol?
amino-(prop-2-enylamino)methanol has a molecular weight of 102.14 g/mol, XLogP of -1.00, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for amino-(prop-2-enylamino)methanol is sourced from PubChem (CID 126627121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).