(1,2,3-13C3)cyclopropanamine

C3H7N — CID 76972988

IUPAC(1,2,3-13C3)cyclopropanamine
SMILESN[13CH]1[13CH2][13CH2]1
InChIInChI=1S/C3H7N/c4-3-1-2-3/h3H,1-2,4H2/i1+1,2+1,3+1
InChIKeyHTJDQJBWANPRPF-VMIGTVKRSA-N
MW60.07 g/mol
LogP0.11
Rot. Bonds

About (1,2,3-13C3)cyclopropanamine

(1,2,3-13C3)cyclopropanamine (PubChem CID 76972988) has the molecular formula C3H7N and a molecular weight of 60.07 g/mol. Its IUPAC name is (1,2,3-13C3)cyclopropanamine.

Molecular Properties

Compound Name(1,2,3-13C3)cyclopropanamine
PubChem CID76972988
Molecular FormulaC3H7N
Molecular Weight60.07 g/mol
Exact Mass60.07
IUPAC Name(1,2,3-13C3)cyclopropanamine
SMILESN[13CH]1[13CH2][13CH2]1
InChIInChI=1S/C3H7N/c4-3-1-2-3/h3H,1-2,4H2/i1+1,2+1,3+1
InChIKeyHTJDQJBWANPRPF-VMIGTVKRSA-N
XLogP0.11
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50060.07
LogP ≤ 50.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

cyclopropanamine;hydrochloride;hydrofluoride
CID 174873111
cyclohexane-1,4-diamine;hydrochloride
CID 54599176
azane;cyclopentanamine
CID 69254255
CID 175698442
CID 175698442
cyclopropanamine;cyclopropanol
CID 67718225
cyclopropanamine;N-methylmethanamine
CID 69172103
cyclopentanamine;platinum(2+)
CID 21144800
cyclopropanamine;formamide
CID 174711245
cyclohexane-1,4-diamine;ethane-1,2-diamine
CID 70127275
carbonic acid;cyclopropanamine
CID 70000861
azane;cycloheptanamine
CID 135353953
4-amino(1,2,3,4,5,6-13C6)cyclohexan-1-ol
CID 172990620

Frequently Asked Questions

What is the IUPAC name of (1,2,3-13C3)cyclopropanamine?
The IUPAC name of (1,2,3-13C3)cyclopropanamine (CID 76972988) is (1,2,3-13C3)cyclopropanamine.
What is the SMILES notation for (1,2,3-13C3)cyclopropanamine?
The canonical SMILES for (1,2,3-13C3)cyclopropanamine is N[13CH]1[13CH2][13CH2]1.
What is the InChIKey of (1,2,3-13C3)cyclopropanamine?
The InChIKey is HTJDQJBWANPRPF-VMIGTVKRSA-N. The full InChI is InChI=1S/C3H7N/c4-3-1-2-3/h3H,1-2,4H2/i1+1,2+1,3+1.
What are the key properties of (1,2,3-13C3)cyclopropanamine?
(1,2,3-13C3)cyclopropanamine has a molecular weight of 60.07 g/mol, XLogP of 0.11, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1,2,3-13C3)cyclopropanamine is sourced from PubChem (CID 76972988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).