N-ethyl-1-(3-fluoro-5-methylpiperidin-4-yl)piperidine-4-carboxamide

C14H26FN3O — CID 123594714

IUPACN-ethyl-1-(3-fluoro-5-methylpiperidin-4-yl)piperidine-4-carboxamide
SMILESCCNC(=O)C1CCN(C2C(C)CNCC2F)CC1
InChIInChI=1S/C14H26FN3O/c1-3-17-14(19)11-4-6-18(7-5-11)13-10(2)8-16-9-12(13)15/h10-13,16H,3-9H2,1-2H3,(H,17,19)
InChIKeyWWUUGQFVSKNPOM-UHFFFAOYSA-N
MW271.38 g/mol
LogP0.78
Rot. Bonds3

About N-ethyl-1-(3-fluoro-5-methylpiperidin-4-yl)piperidine-4-carboxamide

N-ethyl-1-(3-fluoro-5-methylpiperidin-4-yl)piperidine-4-carboxamide (PubChem CID 123594714) has the molecular formula C14H26FN3O and a molecular weight of 271.38 g/mol. Its IUPAC name is N-ethyl-1-(3-fluoro-5-methylpiperidin-4-yl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-ethyl-1-(3-fluoro-5-methylpiperidin-4-yl)piperidine-4-carboxamide
PubChem CID123594714
Molecular FormulaC14H26FN3O
Molecular Weight271.38 g/mol
Exact Mass271.21
IUPAC NameN-ethyl-1-(3-fluoro-5-methylpiperidin-4-yl)piperidine-4-carboxamide
SMILESCCNC(=O)C1CCN(C2C(C)CNCC2F)CC1
InChIInChI=1S/C14H26FN3O/c1-3-17-14(19)11-4-6-18(7-5-11)13-10(2)8-16-9-12(13)15/h10-13,16H,3-9H2,1-2H3,(H,17,19)
InChIKeyWWUUGQFVSKNPOM-UHFFFAOYSA-N
XLogP0.78
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.38
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(dimethylamino)propyl]piperidine-4-carboxamide
CID 2186960
1-acetyl-N-(1-propylpiperidin-4-yl)piperidine-4-carboxamide
CID 6467229
1-(Piperidin-4-ylcarbonyl)piperidine
CID 2794688
1-Methyl-4-(piperidine-4-carbonyl)piperazine
CID 2760037
4-(Piperidine-1-carbonyl)piperidine hydrochloride
CID 17385515
1-(4-Aminopiperidin-1-yl)-2-ethylbutan-1-one
CID 20117980
1-acetyl-N-(2-piperidin-1-ylethyl)piperidine-4-carboxamide
CID 6464517
1-acetyl-N-[2-(3-methylpiperidin-1-yl)ethyl]piperidine-4-carboxamide
CID 53501895
1-(Piperidine-4-carbonyl)piperidine-4-carboxamide
CID 7183149
N-[3-(diethylamino)propyl]piperidine-4-carboxamide
CID 16769745
Piperazin-1-yl(piperidin-4-yl)methanone
CID 22721869
N,N-bis(propan-2-yl)piperidine-4-carboxamide
CID 22959054

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(3-fluoro-5-methylpiperidin-4-yl)piperidine-4-carboxamide?
The IUPAC name of N-ethyl-1-(3-fluoro-5-methylpiperidin-4-yl)piperidine-4-carboxamide (CID 123594714) is N-ethyl-1-(3-fluoro-5-methylpiperidin-4-yl)piperidine-4-carboxamide.
What is the SMILES notation for N-ethyl-1-(3-fluoro-5-methylpiperidin-4-yl)piperidine-4-carboxamide?
The canonical SMILES for N-ethyl-1-(3-fluoro-5-methylpiperidin-4-yl)piperidine-4-carboxamide is CCNC(=O)C1CCN(C2C(C)CNCC2F)CC1.
What is the InChIKey of N-ethyl-1-(3-fluoro-5-methylpiperidin-4-yl)piperidine-4-carboxamide?
The InChIKey is WWUUGQFVSKNPOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26FN3O/c1-3-17-14(19)11-4-6-18(7-5-11)13-10(2)8-16-9-12(13)15/h10-13,16H,3-9H2,1-2H3,(H,17,19).
What are the key properties of N-ethyl-1-(3-fluoro-5-methylpiperidin-4-yl)piperidine-4-carboxamide?
N-ethyl-1-(3-fluoro-5-methylpiperidin-4-yl)piperidine-4-carboxamide has a molecular weight of 271.38 g/mol, XLogP of 0.78, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(3-fluoro-5-methylpiperidin-4-yl)piperidine-4-carboxamide is sourced from PubChem (CID 123594714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).