1-(1-acetylpiperidin-4-yl)cyclopropane-1-carboxamide

C11H18N2O2 — CID 68593661

IUPAC1-(1-acetylpiperidin-4-yl)cyclopropane-1-carboxamide
SMILESCC(=O)N1CCC(C2(C(N)=O)CC2)CC1
InChIInChI=1S/C11H18N2O2/c1-8(14)13-6-2-9(3-7-13)11(4-5-11)10(12)15/h9H,2-7H2,1H3,(H2,12,15)
InChIKeyMFSXHYHWWXWMDW-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.51
Rot. Bonds2

About 1-(1-acetylpiperidin-4-yl)cyclopropane-1-carboxamide

1-(1-acetylpiperidin-4-yl)cyclopropane-1-carboxamide (PubChem CID 68593661) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 1-(1-acetylpiperidin-4-yl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-(1-acetylpiperidin-4-yl)cyclopropane-1-carboxamide
PubChem CID68593661
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name1-(1-acetylpiperidin-4-yl)cyclopropane-1-carboxamide
SMILESCC(=O)N1CCC(C2(C(N)=O)CC2)CC1
InChIInChI=1S/C11H18N2O2/c1-8(14)13-6-2-9(3-7-13)11(4-5-11)10(12)15/h9H,2-7H2,1H3,(H2,12,15)
InChIKeyMFSXHYHWWXWMDW-UHFFFAOYSA-N
XLogP0.51
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

US10730889, Example 32
CID 89793408
1-(Pyrrolidine-1-carbonyl)-6-azaspiro[2.5]octane
CID 64069528
1-(4-Cyclopropylpiperidin-1-yl)-2,2-dimethylpropan-1-one
CID 126750056
N-methyl-6-azaspiro[2.5]octane-1-carboxamide hydrochloride
CID 165983168
N-(2-cyanoethyl)-2-[(3R,4S)-1-(cyclopropanecarbonyl)-3-ethylpiperidin-4-yl]-N-methylacetamide
CID 11912224
2-[(3R,4S)-1-acetyl-3-ethylpiperidin-4-yl]-N-cyclopropylacetamide
CID 11912296
9-(Cyclopropylmethyl)-3-propanoyl-3,9-diazaspiro[5.6]dodecan-10-one
CID 110196191
9-(Cyclopropylmethyl)-3-(2-methylpropanoyl)-3,9-diazaspiro[5.6]dodecan-10-one
CID 124042006
Tetramethylpiperidon
CID 18413099
Hexamethylpiperidone
CID 129812397
N-(cyclopropylmethyl)-6-azaspiro[2.5]octane-1-carboxamide
CID 64067958
N-Cyclopropyl-N-methyl-6-azaspiro[2.5]octane-1-carboxamide
CID 64068366

Frequently Asked Questions

What is the IUPAC name of 1-(1-acetylpiperidin-4-yl)cyclopropane-1-carboxamide?
The IUPAC name of 1-(1-acetylpiperidin-4-yl)cyclopropane-1-carboxamide (CID 68593661) is 1-(1-acetylpiperidin-4-yl)cyclopropane-1-carboxamide.
What is the SMILES notation for 1-(1-acetylpiperidin-4-yl)cyclopropane-1-carboxamide?
The canonical SMILES for 1-(1-acetylpiperidin-4-yl)cyclopropane-1-carboxamide is CC(=O)N1CCC(C2(C(N)=O)CC2)CC1.
What is the InChIKey of 1-(1-acetylpiperidin-4-yl)cyclopropane-1-carboxamide?
The InChIKey is MFSXHYHWWXWMDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-8(14)13-6-2-9(3-7-13)11(4-5-11)10(12)15/h9H,2-7H2,1H3,(H2,12,15).
What are the key properties of 1-(1-acetylpiperidin-4-yl)cyclopropane-1-carboxamide?
1-(1-acetylpiperidin-4-yl)cyclopropane-1-carboxamide has a molecular weight of 210.28 g/mol, XLogP of 0.51, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-acetylpiperidin-4-yl)cyclopropane-1-carboxamide is sourced from PubChem (CID 68593661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).