3-(cyclopropylamino)-1-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]piperidin-2-one

C14H27N3O2 — CID 106149590

IUPAC3-(cyclopropylamino)-1-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]piperidin-2-one
SMILESCN(C)CC(C)(O)CN1CCCC(NC2CC2)C1=O
InChIInChI=1S/C14H27N3O2/c1-14(19,9-16(2)3)10-17-8-4-5-12(13(17)18)15-11-6-7-11/h11-12,15,19H,4-10H2,1-3H3
InChIKeyBUKQQWZEBBRKAZ-UHFFFAOYSA-N
MW269.39 g/mol
LogP0.04
Rot. Bonds6

About 3-(cyclopropylamino)-1-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]piperidin-2-one

3-(cyclopropylamino)-1-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]piperidin-2-one (PubChem CID 106149590) has the molecular formula C14H27N3O2 and a molecular weight of 269.39 g/mol. Its IUPAC name is 3-(cyclopropylamino)-1-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]piperidin-2-one.

Molecular Properties

Compound Name3-(cyclopropylamino)-1-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]piperidin-2-one
PubChem CID106149590
Molecular FormulaC14H27N3O2
Molecular Weight269.39 g/mol
Exact Mass269.21
IUPAC Name3-(cyclopropylamino)-1-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]piperidin-2-one
SMILESCN(C)CC(C)(O)CN1CCCC(NC2CC2)C1=O
InChIInChI=1S/C14H27N3O2/c1-14(19,9-16(2)3)10-17-8-4-5-12(13(17)18)15-11-6-7-11/h11-12,15,19H,4-10H2,1-3H3
InChIKeyBUKQQWZEBBRKAZ-UHFFFAOYSA-N
XLogP0.04
TPSA55.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 50.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-hydroxy-2,4-dimethylpentyl)-3-(methylamino)piperidin-2-one
CID 66173488
3-(ethylamino)-1-(2-hydroxy-2-methylbutyl)piperidin-2-one
CID 65112678
3-(cyclopropylamino)-1-(2-hydroxy-4,4-dimethylpentyl)piperidin-2-one
CID 107159445
1-(2-hydroxy-2-methyl-3-methylsulfanylpropyl)-3-(methylamino)piperidin-2-one
CID 106248107
3-(cyclopropylamino)-1-[2-(1-methylpiperidin-4-yl)ethyl]piperidin-2-one
CID 114516757
(3R)-3-(thian-4-ylamino)-1-(2,2,2-trifluoroethyl)piperidin-2-one
CID 97104581
3-(cyclopropylamino)-1-[(1-methylcyclobutyl)methyl]piperidin-2-one
CID 114109373
N-cyclopropyl-3-[3-(cyclopropylamino)-2-oxopiperidin-1-yl]propanamide
CID 79400868
3-(cyclopropylamino)-1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-2-one
CID 114185131
3-(cyclopropylamino)-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidin-2-one
CID 79238476
3-(cyclopropylamino)-1-[3-(2-hydroxyethoxy)propyl]piperidin-2-one
CID 106305737
2,2-dimethyl-3-[3-(methylamino)-2-oxopiperidin-1-yl]propanamide
CID 106277942

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylamino)-1-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]piperidin-2-one?
The IUPAC name of 3-(cyclopropylamino)-1-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]piperidin-2-one (CID 106149590) is 3-(cyclopropylamino)-1-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]piperidin-2-one.
What is the SMILES notation for 3-(cyclopropylamino)-1-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]piperidin-2-one?
The canonical SMILES for 3-(cyclopropylamino)-1-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]piperidin-2-one is CN(C)CC(C)(O)CN1CCCC(NC2CC2)C1=O.
What is the InChIKey of 3-(cyclopropylamino)-1-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]piperidin-2-one?
The InChIKey is BUKQQWZEBBRKAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O2/c1-14(19,9-16(2)3)10-17-8-4-5-12(13(17)18)15-11-6-7-11/h11-12,15,19H,4-10H2,1-3H3.
What are the key properties of 3-(cyclopropylamino)-1-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]piperidin-2-one?
3-(cyclopropylamino)-1-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]piperidin-2-one has a molecular weight of 269.39 g/mol, XLogP of 0.04, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylamino)-1-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]piperidin-2-one is sourced from PubChem (CID 106149590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).