propanamide;propan-1-amine

C6H16N2O — CID 118437692

IUPACpropanamide;propan-1-amine
SMILESCCC(N)=O.CCCN
InChIInChI=1S/C3H7NO.C3H9N/c1-2-3(4)5;1-2-3-4/h2H2,1H3,(H2,4,5);2-4H2,1H3
InChIKeyBLOBILBSHCUWKC-UHFFFAOYSA-N
MW132.21 g/mol
LogP0.24
Rot. Bonds2

About propanamide;propan-1-amine

propanamide;propan-1-amine (PubChem CID 118437692) has the molecular formula C6H16N2O and a molecular weight of 132.21 g/mol. Its IUPAC name is propanamide;propan-1-amine.

Molecular Properties

Compound Namepropanamide;propan-1-amine
PubChem CID118437692
Molecular FormulaC6H16N2O
Molecular Weight132.21 g/mol
Exact Mass132.13
IUPAC Namepropanamide;propan-1-amine
SMILESCCC(N)=O.CCCN
InChIInChI=1S/C3H7NO.C3H9N/c1-2-3(4)5;1-2-3-4/h2H2,1H3,(H2,4,5);2-4H2,1H3
InChIKeyBLOBILBSHCUWKC-UHFFFAOYSA-N
XLogP0.24
TPSA69.11 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.21
LogP ≤ 50.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of propanamide;propan-1-amine?
The IUPAC name of propanamide;propan-1-amine (CID 118437692) is propanamide;propan-1-amine.
What is the SMILES notation for propanamide;propan-1-amine?
The canonical SMILES for propanamide;propan-1-amine is CCC(N)=O.CCCN.
What is the InChIKey of propanamide;propan-1-amine?
The InChIKey is BLOBILBSHCUWKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7NO.C3H9N/c1-2-3(4)5;1-2-3-4/h2H2,1H3,(H2,4,5);2-4H2,1H3.
What are the key properties of propanamide;propan-1-amine?
propanamide;propan-1-amine has a molecular weight of 132.21 g/mol, XLogP of 0.24, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for propanamide;propan-1-amine is sourced from PubChem (CID 118437692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).