5-(butylamino)-1-methylpiperidin-2-one

C10H20N2O — CID 64655124

IUPAC5-(butylamino)-1-methylpiperidin-2-one
SMILESCCCCNC1CCC(=O)N(C)C1
InChIInChI=1S/C10H20N2O/c1-3-4-7-11-9-5-6-10(13)12(2)8-9/h9,11H,3-8H2,1-2H3
InChIKeyRUONACVLBAAHNA-UHFFFAOYSA-N
MW184.28 g/mol
LogP1.00
Rot. Bonds4

About 5-(butylamino)-1-methylpiperidin-2-one

5-(butylamino)-1-methylpiperidin-2-one (PubChem CID 64655124) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 5-(butylamino)-1-methylpiperidin-2-one.

Molecular Properties

Compound Name5-(butylamino)-1-methylpiperidin-2-one
PubChem CID64655124
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name5-(butylamino)-1-methylpiperidin-2-one
SMILESCCCCNC1CCC(=O)N(C)C1
InChIInChI=1S/C10H20N2O/c1-3-4-7-11-9-5-6-10(13)12(2)8-9/h9,11H,3-8H2,1-2H3
InChIKeyRUONACVLBAAHNA-UHFFFAOYSA-N
XLogP1.00
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-(hexylamino)-1-methylpiperidin-2-one
CID 64654704
1-methyl-5-(propylamino)piperidin-2-one
CID 64655123
1-methyl-5-(4-methylpentylamino)piperidin-2-one
CID 83155530
5-(5-hydroxypentylamino)-1-methylpiperidin-2-one
CID 64656153
1-methyl-5-(2-pyrrolidin-1-ylethylamino)piperidin-2-one
CID 107911656
1-methyl-5-(2-methylbutylamino)piperidin-2-one
CID 64654315
1-methyl-5-(pentan-2-ylamino)piperidin-2-one
CID 64654876
1-methyl-5-(2-morpholin-4-ylethylamino)piperidin-2-one
CID 64655351
N,N-dimethyl-3-[(1-methyl-6-oxopiperidin-3-yl)amino]propanamide
CID 64656353
1-methyl-5-(prop-2-enylamino)piperidin-2-one
CID 64656943
1-methyl-5-(2-methylprop-2-enylamino)piperidin-2-one
CID 64654537
5-[(3-butoxy-2-hydroxypropyl)amino]-1-methylpiperidin-2-one
CID 107262846

Frequently Asked Questions

What is the IUPAC name of 5-(butylamino)-1-methylpiperidin-2-one?
The IUPAC name of 5-(butylamino)-1-methylpiperidin-2-one (CID 64655124) is 5-(butylamino)-1-methylpiperidin-2-one.
What is the SMILES notation for 5-(butylamino)-1-methylpiperidin-2-one?
The canonical SMILES for 5-(butylamino)-1-methylpiperidin-2-one is CCCCNC1CCC(=O)N(C)C1.
What is the InChIKey of 5-(butylamino)-1-methylpiperidin-2-one?
The InChIKey is RUONACVLBAAHNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-3-4-7-11-9-5-6-10(13)12(2)8-9/h9,11H,3-8H2,1-2H3.
What are the key properties of 5-(butylamino)-1-methylpiperidin-2-one?
5-(butylamino)-1-methylpiperidin-2-one has a molecular weight of 184.28 g/mol, XLogP of 1.00, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(butylamino)-1-methylpiperidin-2-one is sourced from PubChem (CID 64655124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).