4-amino-N-cyclopropyl-3-piperidin-1-ylbutanamide

C12H23N3O — CID 66431608

IUPAC4-amino-N-cyclopropyl-3-piperidin-1-ylbutanamide
SMILESNCC(CC(=O)NC1CC1)N1CCCCC1
InChIInChI=1S/C12H23N3O/c13-9-11(15-6-2-1-3-7-15)8-12(16)14-10-4-5-10/h10-11H,1-9,13H2,(H,14,16)
InChIKeyOGPNTKWXSOZWCK-UHFFFAOYSA-N
MW225.34 g/mol
LogP0.47
Rot. Bonds5

About 4-amino-N-cyclopropyl-3-piperidin-1-ylbutanamide

4-amino-N-cyclopropyl-3-piperidin-1-ylbutanamide (PubChem CID 66431608) has the molecular formula C12H23N3O and a molecular weight of 225.34 g/mol. Its IUPAC name is 4-amino-N-cyclopropyl-3-piperidin-1-ylbutanamide.

Molecular Properties

Compound Name4-amino-N-cyclopropyl-3-piperidin-1-ylbutanamide
PubChem CID66431608
Molecular FormulaC12H23N3O
Molecular Weight225.34 g/mol
Exact Mass225.18
IUPAC Name4-amino-N-cyclopropyl-3-piperidin-1-ylbutanamide
SMILESNCC(CC(=O)NC1CC1)N1CCCCC1
InChIInChI=1S/C12H23N3O/c13-9-11(15-6-2-1-3-7-15)8-12(16)14-10-4-5-10/h10-11H,1-9,13H2,(H,14,16)
InChIKeyOGPNTKWXSOZWCK-UHFFFAOYSA-N
XLogP0.47
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-cyclopropyl-3-(4-propan-2-ylazepan-1-yl)butanamide
CID 66429992
4-amino-3-(4-cyclopentylpiperazin-1-yl)-N-cyclopropylbutanamide
CID 66432440
4-amino-N-cyclopropyl-3-(3,4,5-trimethylpiperazin-1-yl)butanamide
CID 114537377
4-amino-N-cyclopropyl-3-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)butanamide
CID 66430397
2-[4-(1-aminobutan-2-yl)piperazin-1-yl]-N-cyclopropylacetamide
CID 63340617
4-amino-N-cyclohexyl-3-methylbutanamide
CID 81070976
4-amino-3-(4-tert-butylazepan-1-yl)-N-methylbutanamide
CID 66428208
4-amino-N-cyclobutyl-3-methylbutanamide
CID 81086885
4-amino-3-(4-propan-2-ylazepan-1-yl)butanamide
CID 66426900
4-amino-N-propan-2-yl-3-(4-propan-2-ylpiperazin-1-yl)butanamide
CID 66430565
2-(azepan-1-yl)-3-cyclopropylpropan-1-amine
CID 82399266
4-amino-N-ethyl-3-(4-propylazepan-1-yl)butanamide
CID 66427386

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-cyclopropyl-3-piperidin-1-ylbutanamide?
The IUPAC name of 4-amino-N-cyclopropyl-3-piperidin-1-ylbutanamide (CID 66431608) is 4-amino-N-cyclopropyl-3-piperidin-1-ylbutanamide.
What is the SMILES notation for 4-amino-N-cyclopropyl-3-piperidin-1-ylbutanamide?
The canonical SMILES for 4-amino-N-cyclopropyl-3-piperidin-1-ylbutanamide is NCC(CC(=O)NC1CC1)N1CCCCC1.
What is the InChIKey of 4-amino-N-cyclopropyl-3-piperidin-1-ylbutanamide?
The InChIKey is OGPNTKWXSOZWCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O/c13-9-11(15-6-2-1-3-7-15)8-12(16)14-10-4-5-10/h10-11H,1-9,13H2,(H,14,16).
What are the key properties of 4-amino-N-cyclopropyl-3-piperidin-1-ylbutanamide?
4-amino-N-cyclopropyl-3-piperidin-1-ylbutanamide has a molecular weight of 225.34 g/mol, XLogP of 0.47, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-cyclopropyl-3-piperidin-1-ylbutanamide is sourced from PubChem (CID 66431608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).