N-[(3-ethylpiperidin-2-yl)methyl]pentanamide

C13H26N2O — CID 82735090

IUPACN-[(3-ethylpiperidin-2-yl)methyl]pentanamide
SMILESCCCCC(=O)NCC1NCCCC1CC
InChIInChI=1S/C13H26N2O/c1-3-5-8-13(16)15-10-12-11(4-2)7-6-9-14-12/h11-12,14H,3-10H2,1-2H3,(H,15,16)
InChIKeyMGEXHASIIWBYHA-UHFFFAOYSA-N
MW226.36 g/mol
LogP2.07
Rot. Bonds6

About N-[(3-ethylpiperidin-2-yl)methyl]pentanamide

N-[(3-ethylpiperidin-2-yl)methyl]pentanamide (PubChem CID 82735090) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is N-[(3-ethylpiperidin-2-yl)methyl]pentanamide.

Molecular Properties

Compound NameN-[(3-ethylpiperidin-2-yl)methyl]pentanamide
PubChem CID82735090
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC NameN-[(3-ethylpiperidin-2-yl)methyl]pentanamide
SMILESCCCCC(=O)NCC1NCCCC1CC
InChIInChI=1S/C13H26N2O/c1-3-5-8-13(16)15-10-12-11(4-2)7-6-9-14-12/h11-12,14H,3-10H2,1-2H3,(H,15,16)
InChIKeyMGEXHASIIWBYHA-UHFFFAOYSA-N
XLogP2.07
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(3-ethylpiperidin-2-yl)methyl]acetamide
CID 82734521
N-[[(2R)-pyrrolidin-2-yl]methyl]pentanamide;hydrochloride
CID 175666343
ethyl N-[(3-ethylpiperidin-2-yl)methyl]carbamate
CID 82734865
N-[(3-ethylpiperidin-2-yl)methyl]-2-(4-fluorophenyl)acetamide
CID 82734161
N-[(3-ethylpiperidin-2-yl)methyl]-2-(2,2,2-trifluoroethoxy)acetamide
CID 103206941
N-[(3-ethylpiperidin-2-yl)methyl]-2-methylcyclopentane-1-carboxamide
CID 107176843
N-[(2-hydroxycyclohexyl)methyl]hexanamide
CID 64912157
1-[(3-ethylpiperidin-2-yl)methyl]-3-(4-methylphenyl)urea
CID 82733939
(2S,3S)-2,3-diethylpiperidine
CID 89278402
4-(dipropylamino)-N-(pyrrolidin-2-ylmethyl)butanamide
CID 119511522
2,3-diethylpiperidine;ethane
CID 144800386
2,3-diethylpiperidine;propane
CID 143653277

Frequently Asked Questions

What is the IUPAC name of N-[(3-ethylpiperidin-2-yl)methyl]pentanamide?
The IUPAC name of N-[(3-ethylpiperidin-2-yl)methyl]pentanamide (CID 82735090) is N-[(3-ethylpiperidin-2-yl)methyl]pentanamide.
What is the SMILES notation for N-[(3-ethylpiperidin-2-yl)methyl]pentanamide?
The canonical SMILES for N-[(3-ethylpiperidin-2-yl)methyl]pentanamide is CCCCC(=O)NCC1NCCCC1CC.
What is the InChIKey of N-[(3-ethylpiperidin-2-yl)methyl]pentanamide?
The InChIKey is MGEXHASIIWBYHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-3-5-8-13(16)15-10-12-11(4-2)7-6-9-14-12/h11-12,14H,3-10H2,1-2H3,(H,15,16).
What are the key properties of N-[(3-ethylpiperidin-2-yl)methyl]pentanamide?
N-[(3-ethylpiperidin-2-yl)methyl]pentanamide has a molecular weight of 226.36 g/mol, XLogP of 2.07, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-ethylpiperidin-2-yl)methyl]pentanamide is sourced from PubChem (CID 82735090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).