3-ethyl-N-propan-2-yl-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide

C17H27N3O — CID 63131429

IUPAC3-ethyl-N-propan-2-yl-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide
SMILESCCC1(C(=O)N(Cc2cccnc2)C(C)C)CCCNC1
InChIInChI=1S/C17H27N3O/c1-4-17(8-6-10-19-13-17)16(21)20(14(2)3)12-15-7-5-9-18-11-15/h5,7,9,11,14,19H,4,6,8,10,12-13H2,1-3H3
InChIKeyUWLSJODYIVBPEB-UHFFFAOYSA-N
MW289.42 g/mol
LogP2.60
Rot. Bonds5

About 3-ethyl-N-propan-2-yl-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide

3-ethyl-N-propan-2-yl-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide (PubChem CID 63131429) has the molecular formula C17H27N3O and a molecular weight of 289.42 g/mol. Its IUPAC name is 3-ethyl-N-propan-2-yl-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name3-ethyl-N-propan-2-yl-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide
PubChem CID63131429
Molecular FormulaC17H27N3O
Molecular Weight289.42 g/mol
Exact Mass289.22
IUPAC Name3-ethyl-N-propan-2-yl-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide
SMILESCCC1(C(=O)N(Cc2cccnc2)C(C)C)CCCNC1
InChIInChI=1S/C17H27N3O/c1-4-17(8-6-10-19-13-17)16(21)20(14(2)3)12-15-7-5-9-18-11-15/h5,7,9,11,14,19H,4,6,8,10,12-13H2,1-3H3
InChIKeyUWLSJODYIVBPEB-UHFFFAOYSA-N
XLogP2.60
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-ethyl-N-methyl-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide
CID 63130194
N,3-diethyl-N-(pyridin-4-ylmethyl)piperidine-3-carboxamide
CID 63131555
3-ethyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)piperidine-3-carboxamide
CID 63131759
ethyl 2-[(3-ethylpiperidine-3-carbonyl)-propan-2-ylamino]acetate
CID 63131353
N-propan-2-yl-N-(pyridin-3-ylmethyl)pyrrolidine-2-carboxamide
CID 54873750
3-ethyl-N-(2-methylpropyl)-N-propan-2-ylpyrrolidine-3-carboxamide
CID 63144055
N-[1-(2-chlorophenyl)ethyl]-3-ethyl-N-methylpiperidine-3-carboxamide
CID 63130733
N,3-diethyl-N-(2-phenylethyl)piperidine-3-carboxamide
CID 63131546
3-methyl-N-(2-pyridin-3-ylethyl)piperidine-3-carboxamide;dihydrochloride
CID 119946421
3-ethyl-N-[(1S)-1-pyridin-3-ylethyl]pyrrolidine-3-carboxamide
CID 81404117
2-amino-3-methyl-N-propan-2-yl-N-(pyridin-3-ylmethyl)butanamide
CID 54873763
2-(methylamino)-N-propan-2-yl-N-(pyridin-3-ylmethyl)propanamide
CID 62636984

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-propan-2-yl-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide?
The IUPAC name of 3-ethyl-N-propan-2-yl-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide (CID 63131429) is 3-ethyl-N-propan-2-yl-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide.
What is the SMILES notation for 3-ethyl-N-propan-2-yl-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide?
The canonical SMILES for 3-ethyl-N-propan-2-yl-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide is CCC1(C(=O)N(Cc2cccnc2)C(C)C)CCCNC1.
What is the InChIKey of 3-ethyl-N-propan-2-yl-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide?
The InChIKey is UWLSJODYIVBPEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O/c1-4-17(8-6-10-19-13-17)16(21)20(14(2)3)12-15-7-5-9-18-11-15/h5,7,9,11,14,19H,4,6,8,10,12-13H2,1-3H3.
What are the key properties of 3-ethyl-N-propan-2-yl-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide?
3-ethyl-N-propan-2-yl-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide has a molecular weight of 289.42 g/mol, XLogP of 2.60, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-propan-2-yl-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide is sourced from PubChem (CID 63131429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).