N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-4-(trifluoromethyl)cyclohexan-1-amine

C15H22F3N3 — CID 129340757

IUPACN-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-4-(trifluoromethyl)cyclohexan-1-amine
SMILESFC(F)(F)C1CCC(NC[C@H]2CCc3nccn3C2)CC1
InChIInChI=1S/C15H22F3N3/c16-15(17,18)12-2-4-13(5-3-12)20-9-11-1-6-14-19-7-8-21(14)10-11/h7-8,11-13,20H,1-6,9-10H2/t11-,12?,13?/m1/s1
InChIKeyQNAVYNFNNPWHPF-PNESKVBLSA-N
MW301.36 g/mol
LogP3.16
Rot. Bonds3

About N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-4-(trifluoromethyl)cyclohexan-1-amine

N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-4-(trifluoromethyl)cyclohexan-1-amine (PubChem CID 129340757) has the molecular formula C15H22F3N3 and a molecular weight of 301.36 g/mol. Its IUPAC name is N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-4-(trifluoromethyl)cyclohexan-1-amine.

Molecular Properties

Compound NameN-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-4-(trifluoromethyl)cyclohexan-1-amine
PubChem CID129340757
Molecular FormulaC15H22F3N3
Molecular Weight301.36 g/mol
Exact Mass301.18
IUPAC NameN-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-4-(trifluoromethyl)cyclohexan-1-amine
SMILESFC(F)(F)C1CCC(NC[C@H]2CCc3nccn3C2)CC1
InChIInChI=1S/C15H22F3N3/c16-15(17,18)12-2-4-13(5-3-12)20-9-11-1-6-14-19-7-8-21(14)10-11/h7-8,11-13,20H,1-6,9-10H2/t11-,12?,13?/m1/s1
InChIKeyQNAVYNFNNPWHPF-PNESKVBLSA-N
XLogP3.16
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.36
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-4-(trifluoromethyl)cyclohexan-1-amine?
The IUPAC name of N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-4-(trifluoromethyl)cyclohexan-1-amine (CID 129340757) is N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-4-(trifluoromethyl)cyclohexan-1-amine.
What is the SMILES notation for N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-4-(trifluoromethyl)cyclohexan-1-amine?
The canonical SMILES for N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-4-(trifluoromethyl)cyclohexan-1-amine is FC(F)(F)C1CCC(NC[C@H]2CCc3nccn3C2)CC1.
What is the InChIKey of N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-4-(trifluoromethyl)cyclohexan-1-amine?
The InChIKey is QNAVYNFNNPWHPF-PNESKVBLSA-N. The full InChI is InChI=1S/C15H22F3N3/c16-15(17,18)12-2-4-13(5-3-12)20-9-11-1-6-14-19-7-8-21(14)10-11/h7-8,11-13,20H,1-6,9-10H2/t11-,12?,13?/m1/s1.
What are the key properties of N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-4-(trifluoromethyl)cyclohexan-1-amine?
N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-4-(trifluoromethyl)cyclohexan-1-amine has a molecular weight of 301.36 g/mol, XLogP of 3.16, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-4-(trifluoromethyl)cyclohexan-1-amine is sourced from PubChem (CID 129340757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).