N-[2-(1-methylpiperidin-3-yl)ethyl]-2-(1,2,3,6-tetrahydropyridin-4-yl)acetamide

C15H27N3O — CID 56714892

IUPACN-[2-(1-methylpiperidin-3-yl)ethyl]-2-(1,2,3,6-tetrahydropyridin-4-yl)acetamide
SMILESCN1CCCC(CCNC(=O)CC2=CCNCC2)C1
InChIInChI=1S/C15H27N3O/c1-18-10-2-3-14(12-18)6-9-17-15(19)11-13-4-7-16-8-5-13/h4,14,16H,2-3,5-12H2,1H3,(H,17,19)
InChIKeyXCSBUFVTWQSZMT-UHFFFAOYSA-N
MW265.40 g/mol
LogP1.14
Rot. Bonds5

About N-[2-(1-methylpiperidin-3-yl)ethyl]-2-(1,2,3,6-tetrahydropyridin-4-yl)acetamide

N-[2-(1-methylpiperidin-3-yl)ethyl]-2-(1,2,3,6-tetrahydropyridin-4-yl)acetamide (PubChem CID 56714892) has the molecular formula C15H27N3O and a molecular weight of 265.40 g/mol. Its IUPAC name is N-[2-(1-methylpiperidin-3-yl)ethyl]-2-(1,2,3,6-tetrahydropyridin-4-yl)acetamide.

Molecular Properties

Compound NameN-[2-(1-methylpiperidin-3-yl)ethyl]-2-(1,2,3,6-tetrahydropyridin-4-yl)acetamide
PubChem CID56714892
Molecular FormulaC15H27N3O
Molecular Weight265.40 g/mol
Exact Mass265.22
IUPAC NameN-[2-(1-methylpiperidin-3-yl)ethyl]-2-(1,2,3,6-tetrahydropyridin-4-yl)acetamide
SMILESCN1CCCC(CCNC(=O)CC2=CCNCC2)C1
InChIInChI=1S/C15H27N3O/c1-18-10-2-3-14(12-18)6-9-17-15(19)11-13-4-7-16-8-5-13/h4,14,16H,2-3,5-12H2,1H3,(H,17,19)
InChIKeyXCSBUFVTWQSZMT-UHFFFAOYSA-N
XLogP1.14
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-amino-N-[2-(1-methylpiperidin-3-yl)ethyl]propanamide
CID 115153050
2-(1-methylpiperidin-3-yl)ethylurea
CID 115168583
N-[2-(1-methylpiperidin-3-yl)ethyl]pyrrolidine-3-carboxamide
CID 115159602
N-[2-(1-methylpiperidin-3-yl)ethyl]-2-propan-2-ylsulfanylacetamide
CID 56714335
N-[2-[(3S)-1-methylpiperidin-3-yl]ethyl]-2-propan-2-ylsulfanylacetamide
CID 95207648
2-amino-2-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]propanamide
CID 115152765
N-propan-2-yl-2-(1,2,3,6-tetrahydropyridin-4-yl)acetamide
CID 117125627
1-methyl-N-[2-[(3S)-1-methylpiperidin-3-yl]ethyl]-4,5,6,7-tetrahydroindazole-3-carboxamide
CID 95197422
5-ethyl-4-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]-1H-pyrazole-3-carboxamide
CID 56716648
(E)-4-[2-(1-methylpiperidin-3-yl)ethylamino]-4-oxobut-2-enoic acid
CID 115177299
4-chloro-2-methoxy-N-[2-(1-methylpiperidin-3-yl)ethyl]benzamide
CID 56716852
N-[2-[(3S)-1-methylpiperidin-3-yl]ethyl]-3-(oxazinan-2-yl)propanamide
CID 95188582

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-methylpiperidin-3-yl)ethyl]-2-(1,2,3,6-tetrahydropyridin-4-yl)acetamide?
The IUPAC name of N-[2-(1-methylpiperidin-3-yl)ethyl]-2-(1,2,3,6-tetrahydropyridin-4-yl)acetamide (CID 56714892) is N-[2-(1-methylpiperidin-3-yl)ethyl]-2-(1,2,3,6-tetrahydropyridin-4-yl)acetamide.
What is the SMILES notation for N-[2-(1-methylpiperidin-3-yl)ethyl]-2-(1,2,3,6-tetrahydropyridin-4-yl)acetamide?
The canonical SMILES for N-[2-(1-methylpiperidin-3-yl)ethyl]-2-(1,2,3,6-tetrahydropyridin-4-yl)acetamide is CN1CCCC(CCNC(=O)CC2=CCNCC2)C1.
What is the InChIKey of N-[2-(1-methylpiperidin-3-yl)ethyl]-2-(1,2,3,6-tetrahydropyridin-4-yl)acetamide?
The InChIKey is XCSBUFVTWQSZMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O/c1-18-10-2-3-14(12-18)6-9-17-15(19)11-13-4-7-16-8-5-13/h4,14,16H,2-3,5-12H2,1H3,(H,17,19).
What are the key properties of N-[2-(1-methylpiperidin-3-yl)ethyl]-2-(1,2,3,6-tetrahydropyridin-4-yl)acetamide?
N-[2-(1-methylpiperidin-3-yl)ethyl]-2-(1,2,3,6-tetrahydropyridin-4-yl)acetamide has a molecular weight of 265.40 g/mol, XLogP of 1.14, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-methylpiperidin-3-yl)ethyl]-2-(1,2,3,6-tetrahydropyridin-4-yl)acetamide is sourced from PubChem (CID 56714892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).