1-[4-(1-hydroxybutan-2-ylamino)piperidin-1-yl]ethanone

C11H22N2O2 — CID 43222767

IUPAC1-[4-(1-hydroxybutan-2-ylamino)piperidin-1-yl]ethanone
SMILESCCC(CO)NC1CCN(C(C)=O)CC1
InChIInChI=1S/C11H22N2O2/c1-3-10(8-14)12-11-4-6-13(7-5-11)9(2)15/h10-12,14H,3-8H2,1-2H3
InChIKeySYTORTFMASKJPB-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.36
Rot. Bonds4

About 1-[4-(1-hydroxybutan-2-ylamino)piperidin-1-yl]ethanone

1-[4-(1-hydroxybutan-2-ylamino)piperidin-1-yl]ethanone (PubChem CID 43222767) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 1-[4-(1-hydroxybutan-2-ylamino)piperidin-1-yl]ethanone.

Molecular Properties

Compound Name1-[4-(1-hydroxybutan-2-ylamino)piperidin-1-yl]ethanone
PubChem CID43222767
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name1-[4-(1-hydroxybutan-2-ylamino)piperidin-1-yl]ethanone
SMILESCCC(CO)NC1CCN(C(C)=O)CC1
InChIInChI=1S/C11H22N2O2/c1-3-10(8-14)12-11-4-6-13(7-5-11)9(2)15/h10-12,14H,3-8H2,1-2H3
InChIKeySYTORTFMASKJPB-UHFFFAOYSA-N
XLogP0.36
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl 4-[[(2S)-1-hydroxybutan-2-yl]amino]piperidine-1-carboxylate
CID 104980485
1-[4-(2,6-dimethylheptan-4-ylamino)piperidin-1-yl]ethanone
CID 43745923
cyclopropyl-[4-(pentan-3-ylamino)piperidin-1-yl]methanone
CID 43747893
1-[4-[[(2S)-1-hydroxy-3-methylbutan-2-yl]amino]piperidin-1-yl]ethanone
CID 79254180
2-[(1-acetylpiperidin-4-yl)amino]butanoic acid
CID 115352992
(2S)-2-(cyclooctylamino)butan-1-ol
CID 28723227
4-(1-methoxybutan-2-ylamino)-N,N-dimethylpiperidine-1-carboxamide
CID 83206989
4-[[(2R)-1-hydroxybutan-2-yl]amino]cyclohexan-1-ol
CID 106595214
2-[(1-cyclopropylpyrrolidin-3-yl)amino]butan-1-ol
CID 62981103
1-[3-(hept-6-en-3-ylamino)pyrrolidin-1-yl]ethanone
CID 115893962
ethyl 4-[(1-hydroxy-4-methylpentan-2-yl)amino]piperidine-1-carboxylate
CID 61246563
1-[4-(3-methylbutan-2-ylamino)piperidin-1-yl]ethanone
CID 43223288

Frequently Asked Questions

What is the IUPAC name of 1-[4-(1-hydroxybutan-2-ylamino)piperidin-1-yl]ethanone?
The IUPAC name of 1-[4-(1-hydroxybutan-2-ylamino)piperidin-1-yl]ethanone (CID 43222767) is 1-[4-(1-hydroxybutan-2-ylamino)piperidin-1-yl]ethanone.
What is the SMILES notation for 1-[4-(1-hydroxybutan-2-ylamino)piperidin-1-yl]ethanone?
The canonical SMILES for 1-[4-(1-hydroxybutan-2-ylamino)piperidin-1-yl]ethanone is CCC(CO)NC1CCN(C(C)=O)CC1.
What is the InChIKey of 1-[4-(1-hydroxybutan-2-ylamino)piperidin-1-yl]ethanone?
The InChIKey is SYTORTFMASKJPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-3-10(8-14)12-11-4-6-13(7-5-11)9(2)15/h10-12,14H,3-8H2,1-2H3.
What are the key properties of 1-[4-(1-hydroxybutan-2-ylamino)piperidin-1-yl]ethanone?
1-[4-(1-hydroxybutan-2-ylamino)piperidin-1-yl]ethanone has a molecular weight of 214.31 g/mol, XLogP of 0.36, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(1-hydroxybutan-2-ylamino)piperidin-1-yl]ethanone is sourced from PubChem (CID 43222767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).