N-(2-aminopropyl)propanamide

C6H14N2O — CID 21030189

IUPACN-(2-aminopropyl)propanamide
SMILESCCC(=O)NCC(C)N
InChIInChI=1S/C6H14N2O/c1-3-6(9)8-4-5(2)7/h5H,3-4,7H2,1-2H3,(H,8,9)
InChIKeyIRMBYPYDAHJWQI-UHFFFAOYSA-N
MW130.19 g/mol
LogP-0.14
Rot. Bonds3

About N-(2-aminopropyl)propanamide

N-(2-aminopropyl)propanamide (PubChem CID 21030189) has the molecular formula C6H14N2O and a molecular weight of 130.19 g/mol. Its IUPAC name is N-(2-aminopropyl)propanamide.

Molecular Properties

Compound NameN-(2-aminopropyl)propanamide
PubChem CID21030189
Molecular FormulaC6H14N2O
Molecular Weight130.19 g/mol
Exact Mass130.11
IUPAC NameN-(2-aminopropyl)propanamide
SMILESCCC(=O)NCC(C)N
InChIInChI=1S/C6H14N2O/c1-3-6(9)8-4-5(2)7/h5H,3-4,7H2,1-2H3,(H,8,9)
InChIKeyIRMBYPYDAHJWQI-UHFFFAOYSA-N
XLogP-0.14
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.19
LogP ≤ 5-0.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-aminopropyl)propanamide?
The IUPAC name of N-(2-aminopropyl)propanamide (CID 21030189) is N-(2-aminopropyl)propanamide.
What is the SMILES notation for N-(2-aminopropyl)propanamide?
The canonical SMILES for N-(2-aminopropyl)propanamide is CCC(=O)NCC(C)N.
What is the InChIKey of N-(2-aminopropyl)propanamide?
The InChIKey is IRMBYPYDAHJWQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O/c1-3-6(9)8-4-5(2)7/h5H,3-4,7H2,1-2H3,(H,8,9).
What are the key properties of N-(2-aminopropyl)propanamide?
N-(2-aminopropyl)propanamide has a molecular weight of 130.19 g/mol, XLogP of -0.14, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminopropyl)propanamide is sourced from PubChem (CID 21030189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).