2,2-dimethyl-N-[1-oxo-1-(piperidin-3-ylamino)propan-2-yl]propanamide

C13H25N3O2 — CID 119428227

IUPAC2,2-dimethyl-N-[1-oxo-1-(piperidin-3-ylamino)propan-2-yl]propanamide
SMILESCC(NC(=O)C(C)(C)C)C(=O)NC1CCCNC1
InChIInChI=1S/C13H25N3O2/c1-9(15-12(18)13(2,3)4)11(17)16-10-6-5-7-14-8-10/h9-10,14H,5-8H2,1-4H3,(H,15,18)(H,16,17)
InChIKeySKEGNAYFKQNFES-UHFFFAOYSA-N
MW255.36 g/mol
LogP0.41
Rot. Bonds3

About 2,2-dimethyl-N-[1-oxo-1-(piperidin-3-ylamino)propan-2-yl]propanamide

2,2-dimethyl-N-[1-oxo-1-(piperidin-3-ylamino)propan-2-yl]propanamide (PubChem CID 119428227) has the molecular formula C13H25N3O2 and a molecular weight of 255.36 g/mol. Its IUPAC name is 2,2-dimethyl-N-[1-oxo-1-(piperidin-3-ylamino)propan-2-yl]propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-[1-oxo-1-(piperidin-3-ylamino)propan-2-yl]propanamide
PubChem CID119428227
Molecular FormulaC13H25N3O2
Molecular Weight255.36 g/mol
Exact Mass255.19
IUPAC Name2,2-dimethyl-N-[1-oxo-1-(piperidin-3-ylamino)propan-2-yl]propanamide
SMILESCC(NC(=O)C(C)(C)C)C(=O)NC1CCCNC1
InChIInChI=1S/C13H25N3O2/c1-9(15-12(18)13(2,3)4)11(17)16-10-6-5-7-14-8-10/h9-10,14H,5-8H2,1-4H3,(H,15,18)(H,16,17)
InChIKeySKEGNAYFKQNFES-UHFFFAOYSA-N
XLogP0.41
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 50.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[1-oxo-1-(piperidin-3-ylamino)propan-2-yl]propanamide?
The IUPAC name of 2,2-dimethyl-N-[1-oxo-1-(piperidin-3-ylamino)propan-2-yl]propanamide (CID 119428227) is 2,2-dimethyl-N-[1-oxo-1-(piperidin-3-ylamino)propan-2-yl]propanamide.
What is the SMILES notation for 2,2-dimethyl-N-[1-oxo-1-(piperidin-3-ylamino)propan-2-yl]propanamide?
The canonical SMILES for 2,2-dimethyl-N-[1-oxo-1-(piperidin-3-ylamino)propan-2-yl]propanamide is CC(NC(=O)C(C)(C)C)C(=O)NC1CCCNC1.
What is the InChIKey of 2,2-dimethyl-N-[1-oxo-1-(piperidin-3-ylamino)propan-2-yl]propanamide?
The InChIKey is SKEGNAYFKQNFES-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O2/c1-9(15-12(18)13(2,3)4)11(17)16-10-6-5-7-14-8-10/h9-10,14H,5-8H2,1-4H3,(H,15,18)(H,16,17).
What are the key properties of 2,2-dimethyl-N-[1-oxo-1-(piperidin-3-ylamino)propan-2-yl]propanamide?
2,2-dimethyl-N-[1-oxo-1-(piperidin-3-ylamino)propan-2-yl]propanamide has a molecular weight of 255.36 g/mol, XLogP of 0.41, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[1-oxo-1-(piperidin-3-ylamino)propan-2-yl]propanamide is sourced from PubChem (CID 119428227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).