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

C12H21N3O2 — CID 65466835

IUPACN-[1-(1-aminocyclopropanecarbonyl)piperidin-4-yl]propanamide
SMILESCCC(=O)NC1CCN(C(=O)C2(N)CC2)CC1
InChIInChI=1S/C12H21N3O2/c1-2-10(16)14-9-3-7-15(8-4-9)11(17)12(13)5-6-12/h9H,2-8,13H2,1H3,(H,14,16)
InChIKeyCIPYPAKIQKMEKN-UHFFFAOYSA-N
MW239.32 g/mol
LogP-0.01
Rot. Bonds3

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

N-[1-(1-aminocyclopropanecarbonyl)piperidin-4-yl]propanamide (PubChem CID 65466835) has the molecular formula C12H21N3O2 and a molecular weight of 239.32 g/mol. Its IUPAC name is N-[1-(1-aminocyclopropanecarbonyl)piperidin-4-yl]propanamide.

Molecular Properties

Compound NameN-[1-(1-aminocyclopropanecarbonyl)piperidin-4-yl]propanamide
PubChem CID65466835
Molecular FormulaC12H21N3O2
Molecular Weight239.32 g/mol
Exact Mass239.16
IUPAC NameN-[1-(1-aminocyclopropanecarbonyl)piperidin-4-yl]propanamide
SMILESCCC(=O)NC1CCN(C(=O)C2(N)CC2)CC1
InChIInChI=1S/C12H21N3O2/c1-2-10(16)14-9-3-7-15(8-4-9)11(17)12(13)5-6-12/h9H,2-8,13H2,1H3,(H,14,16)
InChIKeyCIPYPAKIQKMEKN-UHFFFAOYSA-N
XLogP-0.01
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 5-0.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(1-aminocyclobutanecarbonyl)piperidin-4-yl]propanamide
CID 81173098
N-[1-(1-aminocyclopropanecarbonyl)piperidin-4-yl]-2-methoxyacetamide
CID 65466624
N-[1-(4-methylpiperidine-4-carbonyl)piperidin-4-yl]propanamide
CID 63122079
2-[4-(1-aminocyclopropanecarbonyl)piperazin-1-yl]-N-cyclopropylacetamide;dihydrochloride
CID 119835232
N-[1-(4-ethylpiperidine-4-carbonyl)piperidin-4-yl]propanamide
CID 63128379
(1-aminocyclopropyl)-(4-propylpiperidin-1-yl)methanone
CID 65466440
(1-aminocyclopropyl)-[4-(diethylamino)piperidin-1-yl]methanone
CID 65466413
N-[1-[3-(propan-2-ylamino)propanoyl]piperidin-4-yl]propanamide
CID 54872195
N-cyclohexyl-4-(propanoylamino)piperidine-1-carboxamide
CID 110820925
1-[1-(1-aminocyclohexanecarbonyl)piperidin-4-yl]-3-cyclohexylurea;hydrochloride
CID 119304292
2-methylpropyl 4-(propanoylamino)piperidine-1-carboxylate
CID 108562132
N-[1-(2-chloroacetyl)pyrrolidin-3-yl]propanamide
CID 154848050

Frequently Asked Questions

What is the IUPAC name of N-[1-(1-aminocyclopropanecarbonyl)piperidin-4-yl]propanamide?
The IUPAC name of N-[1-(1-aminocyclopropanecarbonyl)piperidin-4-yl]propanamide (CID 65466835) is N-[1-(1-aminocyclopropanecarbonyl)piperidin-4-yl]propanamide.
What is the SMILES notation for N-[1-(1-aminocyclopropanecarbonyl)piperidin-4-yl]propanamide?
The canonical SMILES for N-[1-(1-aminocyclopropanecarbonyl)piperidin-4-yl]propanamide is CCC(=O)NC1CCN(C(=O)C2(N)CC2)CC1.
What is the InChIKey of N-[1-(1-aminocyclopropanecarbonyl)piperidin-4-yl]propanamide?
The InChIKey is CIPYPAKIQKMEKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O2/c1-2-10(16)14-9-3-7-15(8-4-9)11(17)12(13)5-6-12/h9H,2-8,13H2,1H3,(H,14,16).
What are the key properties of N-[1-(1-aminocyclopropanecarbonyl)piperidin-4-yl]propanamide?
N-[1-(1-aminocyclopropanecarbonyl)piperidin-4-yl]propanamide has a molecular weight of 239.32 g/mol, XLogP of -0.01, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1-aminocyclopropanecarbonyl)piperidin-4-yl]propanamide is sourced from PubChem (CID 65466835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).