N-[(3R,4R)-1-ethyl-3-methylpiperidin-4-yl]-N-methyl-3-piperidin-4-ylpropanamide

C17H33N3O — CID 125120849

IUPACN-[(3R,4R)-1-ethyl-3-methylpiperidin-4-yl]-N-methyl-3-piperidin-4-ylpropanamide
SMILESCCN1CC[C@@H](N(C)C(=O)CCC2CCNCC2)[C@H](C)C1
InChIInChI=1S/C17H33N3O/c1-4-20-12-9-16(14(2)13-20)19(3)17(21)6-5-15-7-10-18-11-8-15/h14-16,18H,4-13H2,1-3H3/t14-,16-/m1/s1
InChIKeyORPMDLQGPOTXDM-GDBMZVCRSA-N
MW295.47 g/mol
LogP1.95
Rot. Bonds5

About N-[(3R,4R)-1-ethyl-3-methylpiperidin-4-yl]-N-methyl-3-piperidin-4-ylpropanamide

N-[(3R,4R)-1-ethyl-3-methylpiperidin-4-yl]-N-methyl-3-piperidin-4-ylpropanamide (PubChem CID 125120849) has the molecular formula C17H33N3O and a molecular weight of 295.47 g/mol. Its IUPAC name is N-[(3R,4R)-1-ethyl-3-methylpiperidin-4-yl]-N-methyl-3-piperidin-4-ylpropanamide.

Molecular Properties

Compound NameN-[(3R,4R)-1-ethyl-3-methylpiperidin-4-yl]-N-methyl-3-piperidin-4-ylpropanamide
PubChem CID125120849
Molecular FormulaC17H33N3O
Molecular Weight295.47 g/mol
Exact Mass295.26
IUPAC NameN-[(3R,4R)-1-ethyl-3-methylpiperidin-4-yl]-N-methyl-3-piperidin-4-ylpropanamide
SMILESCCN1CC[C@@H](N(C)C(=O)CCC2CCNCC2)[C@H](C)C1
InChIInChI=1S/C17H33N3O/c1-4-20-12-9-16(14(2)13-20)19(3)17(21)6-5-15-7-10-18-11-8-15/h14-16,18H,4-13H2,1-3H3/t14-,16-/m1/s1
InChIKeyORPMDLQGPOTXDM-GDBMZVCRSA-N
XLogP1.95
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.47
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-ethyl-3-methylpiperidin-4-yl)-N-methyl-3-piperidin-4-ylbutanamide
CID 119893449
N-(1-ethyl-3-methylpiperidin-4-yl)-N-methyl-2-pyrrolidin-2-ylacetamide
CID 119893453
(2S)-N-[(3R,4S)-1-ethyl-3-methylpiperidin-4-yl]-N-methyl-6-azaspiro[2.5]octane-2-carboxamide
CID 125118489
N-(1-ethyl-3-methylpiperidin-4-yl)-N-methylpiperidine-3-carboxamide
CID 119893413
N-(1-ethyl-3-methylpiperidin-4-yl)-N-methylmorpholine-2-carboxamide
CID 119893451
3-cyclopropyl-N-methyl-N-piperidin-4-ylpropanamide
CID 119441464
N-butan-2-yl-N-methyl-3-piperidin-4-ylpropanamide
CID 62210682
3-(4-aminocyclohexyl)-N-(1-ethylpiperidin-4-yl)-N-methylpropanamide
CID 62782861
(3R)-3-amino-N-[(3S,4S)-1-ethyl-3-methylpiperidin-4-yl]-N-methyl-3-phenylpropanamide
CID 124683430
1-N,3-N-bis(1-ethyl-3-methylpiperidin-4-yl)-1-N,3-N-dimethylbenzene-1,3-dicarboxamide
CID 166198840
3-[3-[[(3R,4R)-1-ethyl-3-methylpiperidin-4-yl]-methylamino]-3-oxopropyl]-N-methylbenzamide
CID 97239927
N,N,4-trimethyl-1-(2-piperidin-4-ylethyl)pyrrolidin-3-amine
CID 81464634

Frequently Asked Questions

What is the IUPAC name of N-[(3R,4R)-1-ethyl-3-methylpiperidin-4-yl]-N-methyl-3-piperidin-4-ylpropanamide?
The IUPAC name of N-[(3R,4R)-1-ethyl-3-methylpiperidin-4-yl]-N-methyl-3-piperidin-4-ylpropanamide (CID 125120849) is N-[(3R,4R)-1-ethyl-3-methylpiperidin-4-yl]-N-methyl-3-piperidin-4-ylpropanamide.
What is the SMILES notation for N-[(3R,4R)-1-ethyl-3-methylpiperidin-4-yl]-N-methyl-3-piperidin-4-ylpropanamide?
The canonical SMILES for N-[(3R,4R)-1-ethyl-3-methylpiperidin-4-yl]-N-methyl-3-piperidin-4-ylpropanamide is CCN1CC[C@@H](N(C)C(=O)CCC2CCNCC2)[C@H](C)C1.
What is the InChIKey of N-[(3R,4R)-1-ethyl-3-methylpiperidin-4-yl]-N-methyl-3-piperidin-4-ylpropanamide?
The InChIKey is ORPMDLQGPOTXDM-GDBMZVCRSA-N. The full InChI is InChI=1S/C17H33N3O/c1-4-20-12-9-16(14(2)13-20)19(3)17(21)6-5-15-7-10-18-11-8-15/h14-16,18H,4-13H2,1-3H3/t14-,16-/m1/s1.
What are the key properties of N-[(3R,4R)-1-ethyl-3-methylpiperidin-4-yl]-N-methyl-3-piperidin-4-ylpropanamide?
N-[(3R,4R)-1-ethyl-3-methylpiperidin-4-yl]-N-methyl-3-piperidin-4-ylpropanamide has a molecular weight of 295.47 g/mol, XLogP of 1.95, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R,4R)-1-ethyl-3-methylpiperidin-4-yl]-N-methyl-3-piperidin-4-ylpropanamide is sourced from PubChem (CID 125120849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).