N-[1-(1-aminocyclobutanecarbonyl)piperidin-4-yl]propanamide

C13H23N3O2 — CID 81173098

IUPACN-[1-(1-aminocyclobutanecarbonyl)piperidin-4-yl]propanamide
SMILESCCC(=O)NC1CCN(C(=O)C2(N)CCC2)CC1
InChIInChI=1S/C13H23N3O2/c1-2-11(17)15-10-4-8-16(9-5-10)12(18)13(14)6-3-7-13/h10H,2-9,14H2,1H3,(H,15,17)
InChIKeyBQFNMGOKTMPHFX-UHFFFAOYSA-N
MW253.35 g/mol
LogP0.38
Rot. Bonds3

About N-[1-(1-aminocyclobutanecarbonyl)piperidin-4-yl]propanamide

N-[1-(1-aminocyclobutanecarbonyl)piperidin-4-yl]propanamide (PubChem CID 81173098) has the molecular formula C13H23N3O2 and a molecular weight of 253.35 g/mol. Its IUPAC name is N-[1-(1-aminocyclobutanecarbonyl)piperidin-4-yl]propanamide.

Molecular Properties

Compound NameN-[1-(1-aminocyclobutanecarbonyl)piperidin-4-yl]propanamide
PubChem CID81173098
Molecular FormulaC13H23N3O2
Molecular Weight253.35 g/mol
Exact Mass253.18
IUPAC NameN-[1-(1-aminocyclobutanecarbonyl)piperidin-4-yl]propanamide
SMILESCCC(=O)NC1CCN(C(=O)C2(N)CCC2)CC1
InChIInChI=1S/C13H23N3O2/c1-2-11(17)15-10-4-8-16(9-5-10)12(18)13(14)6-3-7-13/h10H,2-9,14H2,1H3,(H,15,17)
InChIKeyBQFNMGOKTMPHFX-UHFFFAOYSA-N
XLogP0.38
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(1-aminocyclopropanecarbonyl)piperidin-4-yl]propanamide
CID 65466835
N-[1-(1-aminocyclopropanecarbonyl)piperidin-4-yl]-2-methoxyacetamide
CID 65466624
1-[1-(1-aminocyclohexanecarbonyl)piperidin-4-yl]-3-cyclohexylurea;hydrochloride
CID 119304292
N-[1-(4-methylpiperidine-4-carbonyl)piperidin-4-yl]propanamide
CID 63122079
N-[1-(4-ethylpiperidine-4-carbonyl)piperidin-4-yl]propanamide
CID 63128379
N-[1-[3-(propan-2-ylamino)propanoyl]piperidin-4-yl]propanamide
CID 54872195
N-cyclohexyl-4-(propanoylamino)piperidine-1-carboxamide
CID 110820925
N-(1-acetylpiperidin-4-yl)-2-(1-aminocyclobutyl)acetamide
CID 79854676
(1-aminocyclobutyl)-[4-[(dimethylamino)methyl]piperidin-1-yl]methanone
CID 81172154
2-[4-(1-aminocyclopropanecarbonyl)piperazin-1-yl]-N-cyclopropylacetamide;dihydrochloride
CID 119835232
(1-aminocyclobutyl)-[4-(diethylaminomethyl)piperidin-1-yl]methanone
CID 81172457
(1-aminocyclobutyl)-(4-tert-butylpiperidin-1-yl)methanone
CID 81169402

Frequently Asked Questions

What is the IUPAC name of N-[1-(1-aminocyclobutanecarbonyl)piperidin-4-yl]propanamide?
The IUPAC name of N-[1-(1-aminocyclobutanecarbonyl)piperidin-4-yl]propanamide (CID 81173098) is N-[1-(1-aminocyclobutanecarbonyl)piperidin-4-yl]propanamide.
What is the SMILES notation for N-[1-(1-aminocyclobutanecarbonyl)piperidin-4-yl]propanamide?
The canonical SMILES for N-[1-(1-aminocyclobutanecarbonyl)piperidin-4-yl]propanamide is CCC(=O)NC1CCN(C(=O)C2(N)CCC2)CC1.
What is the InChIKey of N-[1-(1-aminocyclobutanecarbonyl)piperidin-4-yl]propanamide?
The InChIKey is BQFNMGOKTMPHFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O2/c1-2-11(17)15-10-4-8-16(9-5-10)12(18)13(14)6-3-7-13/h10H,2-9,14H2,1H3,(H,15,17).
What are the key properties of N-[1-(1-aminocyclobutanecarbonyl)piperidin-4-yl]propanamide?
N-[1-(1-aminocyclobutanecarbonyl)piperidin-4-yl]propanamide has a molecular weight of 253.35 g/mol, XLogP of 0.38, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1-aminocyclobutanecarbonyl)piperidin-4-yl]propanamide is sourced from PubChem (CID 81173098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).