cyclopropanamine;formaldehyde

C4H9NO — CID 174964305

IUPACcyclopropanamine;formaldehyde
SMILESC=O.NC1CC1
InChIInChI=1S/C3H7N.CH2O/c4-3-1-2-3;1-2/h3H,1-2,4H2;1H2
InChIKeyDXOUSBYJJDUWOF-UHFFFAOYSA-N
MW87.12 g/mol
LogP-0.08
Rot. Bonds

About cyclopropanamine;formaldehyde

cyclopropanamine;formaldehyde (PubChem CID 174964305) has the molecular formula C4H9NO and a molecular weight of 87.12 g/mol. Its IUPAC name is cyclopropanamine;formaldehyde.

Molecular Properties

Compound Namecyclopropanamine;formaldehyde
PubChem CID174964305
Molecular FormulaC4H9NO
Molecular Weight87.12 g/mol
Exact Mass87.07
IUPAC Namecyclopropanamine;formaldehyde
SMILESC=O.NC1CC1
InChIInChI=1S/C3H7N.CH2O/c4-3-1-2-3;1-2/h3H,1-2,4H2;1H2
InChIKeyDXOUSBYJJDUWOF-UHFFFAOYSA-N
XLogP-0.08
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50087.12
LogP ≤ 5-0.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cyclopropanamine;formaldehyde?
The IUPAC name of cyclopropanamine;formaldehyde (CID 174964305) is cyclopropanamine;formaldehyde.
What is the SMILES notation for cyclopropanamine;formaldehyde?
The canonical SMILES for cyclopropanamine;formaldehyde is C=O.NC1CC1.
What is the InChIKey of cyclopropanamine;formaldehyde?
The InChIKey is DXOUSBYJJDUWOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7N.CH2O/c4-3-1-2-3;1-2/h3H,1-2,4H2;1H2.
What are the key properties of cyclopropanamine;formaldehyde?
cyclopropanamine;formaldehyde has a molecular weight of 87.12 g/mol, XLogP of -0.08, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropanamine;formaldehyde is sourced from PubChem (CID 174964305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).