2-(1-methoxycyclobutyl)-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide

C14H23F3N2O2 — CID 103555827

IUPAC2-(1-methoxycyclobutyl)-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide
SMILESCOC1(CC(=O)N(CC(F)(F)F)C2CCNCC2)CCC1
InChIInChI=1S/C14H23F3N2O2/c1-21-13(5-2-6-13)9-12(20)19(10-14(15,16)17)11-3-7-18-8-4-11/h11,18H,2-10H2,1H3
InChIKeyMKTBQCQUVIYWSX-UHFFFAOYSA-N
MW308.34 g/mol
LogP2.09
Rot. Bonds5

About 2-(1-methoxycyclobutyl)-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide

2-(1-methoxycyclobutyl)-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 103555827) has the molecular formula C14H23F3N2O2 and a molecular weight of 308.34 g/mol. Its IUPAC name is 2-(1-methoxycyclobutyl)-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name2-(1-methoxycyclobutyl)-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID103555827
Molecular FormulaC14H23F3N2O2
Molecular Weight308.34 g/mol
Exact Mass308.17
IUPAC Name2-(1-methoxycyclobutyl)-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide
SMILESCOC1(CC(=O)N(CC(F)(F)F)C2CCNCC2)CCC1
InChIInChI=1S/C14H23F3N2O2/c1-21-13(5-2-6-13)9-12(20)19(10-14(15,16)17)11-3-7-18-8-4-11/h11,18H,2-10H2,1H3
InChIKeyMKTBQCQUVIYWSX-UHFFFAOYSA-N
XLogP2.09
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.34
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,2-difluoro-2-(1-hydroxycyclobutyl)-N-[(3S)-1-(2-methoxyethyl)piperidin-3-yl]acetamide
CID 97250161
N-[1-[2,2-difluoro-2-(1-hydroxycyclobutyl)acetyl]piperidin-3-yl]acetamide
CID 71910697
2,2-difluoro-2-(1-hydroxycyclobutyl)-N-[3-methyl-2-(4-methylpiperazin-1-yl)butyl]acetamide
CID 75395042
2,2-difluoro-2-(1-hydroxycyclobutyl)-N-[1-(2-methoxyethyl)piperidin-3-yl]acetamide
CID 84595120
N-[(3R)-1-[2,2-difluoro-2-(1-hydroxycyclobutyl)acetyl]piperidin-3-yl]acetamide
CID 97098444
N-[(3S)-1-[2,2-difluoro-2-(1-hydroxycyclobutyl)acetyl]piperidin-3-yl]acetamide
CID 97098445
2,2-difluoro-2-(1-hydroxycyclobutyl)-N-[(3R)-1-(2-methoxyethyl)piperidin-3-yl]acetamide
CID 97250162
2,2-difluoro-2-(1-hydroxycyclobutyl)-N-[(2S)-3-methyl-2-(4-methylpiperazin-1-yl)butyl]acetamide
CID 97250400
2,2-difluoro-2-(1-hydroxycyclobutyl)-N-[(2R)-3-methyl-2-(4-methylpiperazin-1-yl)butyl]acetamide
CID 97250401
3-methoxy-3-methyl-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)butanamide
CID 103019511
3-methoxy-3-methyl-N-[6-(trifluoromethyl)piperidin-3-yl]butanamide
CID 103019706
N-(3-amino-2,2-difluoropropyl)-2-(1-methoxycyclobutyl)acetamide
CID 103557394

Frequently Asked Questions

What is the IUPAC name of 2-(1-methoxycyclobutyl)-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of 2-(1-methoxycyclobutyl)-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide (CID 103555827) is 2-(1-methoxycyclobutyl)-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for 2-(1-methoxycyclobutyl)-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for 2-(1-methoxycyclobutyl)-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide is COC1(CC(=O)N(CC(F)(F)F)C2CCNCC2)CCC1.
What is the InChIKey of 2-(1-methoxycyclobutyl)-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is MKTBQCQUVIYWSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23F3N2O2/c1-21-13(5-2-6-13)9-12(20)19(10-14(15,16)17)11-3-7-18-8-4-11/h11,18H,2-10H2,1H3.
What are the key properties of 2-(1-methoxycyclobutyl)-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide?
2-(1-methoxycyclobutyl)-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 308.34 g/mol, XLogP of 2.09, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methoxycyclobutyl)-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 103555827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).