3-(pentylamino)piperidin-2-one

C10H20N2O — CID 62093756

IUPAC3-(pentylamino)piperidin-2-one
SMILESCCCCCNC1CCCNC1=O
InChIInChI=1S/C10H20N2O/c1-2-3-4-7-11-9-6-5-8-12-10(9)13/h9,11H,2-8H2,1H3,(H,12,13)
InChIKeyZZWBCNSRIHABKS-UHFFFAOYSA-N
MW184.28 g/mol
LogP1.04
Rot. Bonds5

About 3-(pentylamino)piperidin-2-one

3-(pentylamino)piperidin-2-one (PubChem CID 62093756) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 3-(pentylamino)piperidin-2-one.

Molecular Properties

Compound Name3-(pentylamino)piperidin-2-one
PubChem CID62093756
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name3-(pentylamino)piperidin-2-one
SMILESCCCCCNC1CCCNC1=O
InChIInChI=1S/C10H20N2O/c1-2-3-4-7-11-9-6-5-8-12-10(9)13/h9,11H,2-8H2,1H3,(H,12,13)
InChIKeyZZWBCNSRIHABKS-UHFFFAOYSA-N
XLogP1.04
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-(dodecylamino)piperidin-2-one
CID 63492267
3-(pentylamino)pyrrolidin-2-one
CID 68641517
3-(3-methylsulfonylpropylamino)piperidin-2-one
CID 63191547
3-(3-ethoxypropylamino)azepan-2-one
CID 43199290
3-(undecan-6-ylamino)piperidin-2-one
CID 55033580
N'-hydroxy-5-[(2-oxopiperidin-3-yl)amino]pentanimidamide
CID 77030093
3-[(2-ethyl-2-hydroxybutyl)amino]piperidin-2-one
CID 114493018
3-(hexan-2-ylamino)piperidin-2-one
CID 62094120
1-decyl-3-[(3S)-2-oxoazepan-3-yl]urea
CID 11392789
3-(3,3,3-trifluoropropylamino)piperidin-2-one
CID 64554624
3-(pent-4-ynylamino)azepan-2-one
CID 103711250
3-(undecan-6-ylamino)azepan-2-one
CID 43782053

Frequently Asked Questions

What is the IUPAC name of 3-(pentylamino)piperidin-2-one?
The IUPAC name of 3-(pentylamino)piperidin-2-one (CID 62093756) is 3-(pentylamino)piperidin-2-one.
What is the SMILES notation for 3-(pentylamino)piperidin-2-one?
The canonical SMILES for 3-(pentylamino)piperidin-2-one is CCCCCNC1CCCNC1=O.
What is the InChIKey of 3-(pentylamino)piperidin-2-one?
The InChIKey is ZZWBCNSRIHABKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-2-3-4-7-11-9-6-5-8-12-10(9)13/h9,11H,2-8H2,1H3,(H,12,13).
What are the key properties of 3-(pentylamino)piperidin-2-one?
3-(pentylamino)piperidin-2-one has a molecular weight of 184.28 g/mol, XLogP of 1.04, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(pentylamino)piperidin-2-one is sourced from PubChem (CID 62093756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).