N-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]methyl]-N-methyl-4-(trifluoromethyl)pyridin-2-amine

C19H24F3N5 — CID 146074450

IUPACN-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]methyl]-N-methyl-4-(trifluoromethyl)pyridin-2-amine
SMILESCc1cc(N2CCC(CN(C)c3cc(C(F)(F)F)ccn3)CC2)nc(C)n1
InChIInChI=1S/C19H24F3N5/c1-13-10-18(25-14(2)24-13)27-8-5-15(6-9-27)12-26(3)17-11-16(4-7-23-17)19(20,21)22/h4,7,10-11,15H,5-6,8-9,12H2,1-3H3
InChIKeyHNRGVQYVSSFKPK-UHFFFAOYSA-N
MW379.43 g/mol
LogP3.86
Rot. Bonds4

About N-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]methyl]-N-methyl-4-(trifluoromethyl)pyridin-2-amine

N-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]methyl]-N-methyl-4-(trifluoromethyl)pyridin-2-amine (PubChem CID 146074450) has the molecular formula C19H24F3N5 and a molecular weight of 379.43 g/mol. Its IUPAC name is N-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]methyl]-N-methyl-4-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]methyl]-N-methyl-4-(trifluoromethyl)pyridin-2-amine
PubChem CID146074450
Molecular FormulaC19H24F3N5
Molecular Weight379.43 g/mol
Exact Mass379.20
IUPAC NameN-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]methyl]-N-methyl-4-(trifluoromethyl)pyridin-2-amine
SMILESCc1cc(N2CCC(CN(C)c3cc(C(F)(F)F)ccn3)CC2)nc(C)n1
InChIInChI=1S/C19H24F3N5/c1-13-10-18(25-14(2)24-13)27-8-5-15(6-9-27)12-26(3)17-11-16(4-7-23-17)19(20,21)22/h4,7,10-11,15H,5-6,8-9,12H2,1-3H3
InChIKeyHNRGVQYVSSFKPK-UHFFFAOYSA-N
XLogP3.86
TPSA45.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.43
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]methyl]-N-methyl-4-(trifluoromethyl)pyridin-2-amine with MolForge

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Related Compounds

N-methyl-N-[[1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperidin-4-yl]methyl]-4-(trifluoromethyl)pyridin-2-amine
CID 146074614
N-methyl-N-[[1-(3-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-yl)piperidin-4-yl]methyl]-4-(trifluoromethyl)pyridin-2-amine
CID 146078864
(3,3-difluorocyclobutyl)-[4-[[methyl-[4-(trifluoromethyl)-2-pyridinyl]amino]methyl]piperidin-1-yl]methanone
CID 146077906
2-[4-(bromomethyl)piperidin-1-yl]-4-(trifluoromethyl)pyridine
CID 80669144
1-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-N-methylmethanamine
CID 62593348
4-[4-(methoxymethyl)piperidin-1-yl]-2,6-dimethylpyrimidine
CID 66801525
N,1-dimethyl-N-[[1-[4-(trifluoromethyl)-2-pyridinyl]piperidin-4-yl]methyl]imidazole-4-carboxamide
CID 172881133
2-(4-bromopiperidin-1-yl)-4-(trifluoromethyl)pyridine
CID 80674656
N-ethyl-4-methyl-6-[4-[4-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyrimidin-2-amine
CID 146079790
1-(2,6-dimethylpyrimidin-4-yl)-N-methyl-N-[[(2R)-oxan-2-yl]methyl]piperidin-4-amine
CID 97004691
(1R)-2-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-methylamino]-1-phenylethanol
CID 97069243
1-(2,6-dimethylpyrimidin-4-yl)-N-methyl-N-(oxan-2-ylmethyl)piperidin-4-amine
CID 71863166

Frequently Asked Questions

What is the IUPAC name of N-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]methyl]-N-methyl-4-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of N-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]methyl]-N-methyl-4-(trifluoromethyl)pyridin-2-amine (CID 146074450) is N-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]methyl]-N-methyl-4-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for N-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]methyl]-N-methyl-4-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for N-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]methyl]-N-methyl-4-(trifluoromethyl)pyridin-2-amine is Cc1cc(N2CCC(CN(C)c3cc(C(F)(F)F)ccn3)CC2)nc(C)n1.
What is the InChIKey of N-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]methyl]-N-methyl-4-(trifluoromethyl)pyridin-2-amine?
The InChIKey is HNRGVQYVSSFKPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24F3N5/c1-13-10-18(25-14(2)24-13)27-8-5-15(6-9-27)12-26(3)17-11-16(4-7-23-17)19(20,21)22/h4,7,10-11,15H,5-6,8-9,12H2,1-3H3.
What are the key properties of N-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]methyl]-N-methyl-4-(trifluoromethyl)pyridin-2-amine?
N-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]methyl]-N-methyl-4-(trifluoromethyl)pyridin-2-amine has a molecular weight of 379.43 g/mol, XLogP of 3.86, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]methyl]-N-methyl-4-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 146074450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).