2-[4-[[3-(trifluoromethyl)cyclohexyl]amino]piperidin-1-yl]acetamide

C14H24F3N3O — CID 64759422

IUPAC2-[4-[[3-(trifluoromethyl)cyclohexyl]amino]piperidin-1-yl]acetamide
SMILESNC(=O)CN1CCC(NC2CCCC(C(F)(F)F)C2)CC1
InChIInChI=1S/C14H24F3N3O/c15-14(16,17)10-2-1-3-12(8-10)19-11-4-6-20(7-5-11)9-13(18)21/h10-12,19H,1-9H2,(H2,18,21)
InChIKeyWNNYEYTVHIBFHW-UHFFFAOYSA-N
MW307.36 g/mol
LogP1.65
Rot. Bonds4

About 2-[4-[[3-(trifluoromethyl)cyclohexyl]amino]piperidin-1-yl]acetamide

2-[4-[[3-(trifluoromethyl)cyclohexyl]amino]piperidin-1-yl]acetamide (PubChem CID 64759422) has the molecular formula C14H24F3N3O and a molecular weight of 307.36 g/mol. Its IUPAC name is 2-[4-[[3-(trifluoromethyl)cyclohexyl]amino]piperidin-1-yl]acetamide.

Molecular Properties

Compound Name2-[4-[[3-(trifluoromethyl)cyclohexyl]amino]piperidin-1-yl]acetamide
PubChem CID64759422
Molecular FormulaC14H24F3N3O
Molecular Weight307.36 g/mol
Exact Mass307.19
IUPAC Name2-[4-[[3-(trifluoromethyl)cyclohexyl]amino]piperidin-1-yl]acetamide
SMILESNC(=O)CN1CCC(NC2CCCC(C(F)(F)F)C2)CC1
InChIInChI=1S/C14H24F3N3O/c15-14(16,17)10-2-1-3-12(8-10)19-11-4-6-20(7-5-11)9-13(18)21/h10-12,19H,1-9H2,(H2,18,21)
InChIKeyWNNYEYTVHIBFHW-UHFFFAOYSA-N
XLogP1.65
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.36
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-aminopiperidin-1-yl)-N-[3-(trifluoromethyl)cyclohexyl]acetamide
CID 79322864
2-[4-[(4-methylcycloheptyl)amino]piperidin-1-yl]acetamide
CID 65079766
trans-(1R,3R)-3-(trifluoromethyl)-N-[(1R,3S)-3-(trifluoromethyl)cyclohexyl]cyclohexan-1-amine
CID 39870295
2-[4-[(3-methylcyclobutyl)amino]piperidin-1-yl]acetamide
CID 104859652
1-[(3S)-3-[[(1S,3R)-3-(trifluoromethyl)cyclohexyl]amino]pyrrolidin-1-yl]propan-1-one
CID 129430039
1-methylsulfonyl-N-[3-(trifluoromethyl)cyclohexyl]piperidin-4-amine
CID 64757172
2-[4-[(4,4-dimethylcycloheptyl)amino]piperidin-1-yl]acetamide
CID 65083386
2-[4-[(1-oxothian-4-yl)amino]piperidin-1-yl]acetamide
CID 54981867
2-[4-[(3-methoxycyclobutyl)amino]piperidin-1-yl]acetamide
CID 104870851
2-[4-[(1-propan-2-ylpiperidin-4-yl)amino]piperidin-1-yl]acetamide
CID 43746779
4-(2-amino-2-oxoethyl)-N-[(1S,3S)-3-(trifluoromethyl)cyclohexyl]piperidine-1-carboxamide
CID 94050688
3-[[3-(trifluoromethyl)cyclohexyl]amino]butanamide
CID 113250164

Frequently Asked Questions

What is the IUPAC name of 2-[4-[[3-(trifluoromethyl)cyclohexyl]amino]piperidin-1-yl]acetamide?
The IUPAC name of 2-[4-[[3-(trifluoromethyl)cyclohexyl]amino]piperidin-1-yl]acetamide (CID 64759422) is 2-[4-[[3-(trifluoromethyl)cyclohexyl]amino]piperidin-1-yl]acetamide.
What is the SMILES notation for 2-[4-[[3-(trifluoromethyl)cyclohexyl]amino]piperidin-1-yl]acetamide?
The canonical SMILES for 2-[4-[[3-(trifluoromethyl)cyclohexyl]amino]piperidin-1-yl]acetamide is NC(=O)CN1CCC(NC2CCCC(C(F)(F)F)C2)CC1.
What is the InChIKey of 2-[4-[[3-(trifluoromethyl)cyclohexyl]amino]piperidin-1-yl]acetamide?
The InChIKey is WNNYEYTVHIBFHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24F3N3O/c15-14(16,17)10-2-1-3-12(8-10)19-11-4-6-20(7-5-11)9-13(18)21/h10-12,19H,1-9H2,(H2,18,21).
What are the key properties of 2-[4-[[3-(trifluoromethyl)cyclohexyl]amino]piperidin-1-yl]acetamide?
2-[4-[[3-(trifluoromethyl)cyclohexyl]amino]piperidin-1-yl]acetamide has a molecular weight of 307.36 g/mol, XLogP of 1.65, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[[3-(trifluoromethyl)cyclohexyl]amino]piperidin-1-yl]acetamide is sourced from PubChem (CID 64759422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).