[2-(1-cyclopentylpropan-2-ylamino)-5-(trifluoromethyl)-3-pyridinyl]methanol

C15H21F3N2O — CID 68963290

IUPAC[2-(1-cyclopentylpropan-2-ylamino)-5-(trifluoromethyl)-3-pyridinyl]methanol
SMILESCC(CC1CCCC1)Nc1ncc(C(F)(F)F)cc1CO
InChIInChI=1S/C15H21F3N2O/c1-10(6-11-4-2-3-5-11)20-14-12(9-21)7-13(8-19-14)15(16,17)18/h7-8,10-11,21H,2-6,9H2,1H3,(H,19,20)
InChIKeyRYPYTVQRYSFCMM-UHFFFAOYSA-N
MW302.34 g/mol
LogP3.97
Rot. Bonds5

About [2-(1-cyclopentylpropan-2-ylamino)-5-(trifluoromethyl)-3-pyridinyl]methanol

[2-(1-cyclopentylpropan-2-ylamino)-5-(trifluoromethyl)-3-pyridinyl]methanol (PubChem CID 68963290) has the molecular formula C15H21F3N2O and a molecular weight of 302.34 g/mol. Its IUPAC name is [2-(1-cyclopentylpropan-2-ylamino)-5-(trifluoromethyl)-3-pyridinyl]methanol.

Molecular Properties

Compound Name[2-(1-cyclopentylpropan-2-ylamino)-5-(trifluoromethyl)-3-pyridinyl]methanol
PubChem CID68963290
Molecular FormulaC15H21F3N2O
Molecular Weight302.34 g/mol
Exact Mass302.16
IUPAC Name[2-(1-cyclopentylpropan-2-ylamino)-5-(trifluoromethyl)-3-pyridinyl]methanol
SMILESCC(CC1CCCC1)Nc1ncc(C(F)(F)F)cc1CO
InChIInChI=1S/C15H21F3N2O/c1-10(6-11-4-2-3-5-11)20-14-12(9-21)7-13(8-19-14)15(16,17)18/h7-8,10-11,21H,2-6,9H2,1H3,(H,19,20)
InChIKeyRYPYTVQRYSFCMM-UHFFFAOYSA-N
XLogP3.97
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.34
LogP ≤ 53.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-chloro-N-(3-cyclopentylpropyl)-5-(trifluoromethyl)pyridin-2-amine
CID 106012866
3-chloro-N-(dicyclopropylmethyl)-5-(trifluoromethyl)pyridin-2-amine
CID 60712371
3-chloro-N-(2-methylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine
CID 43081784
3-chloro-N-(1-methoxypropan-2-yl)-5-(trifluoromethyl)pyridin-2-amine
CID 43080874
3-N-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]butane-1,3-diamine
CID 83180248
[2-cyclopentyl-1-[5-(trifluoromethyl)-2-pyridinyl]ethyl]hydrazine
CID 105299053
2-(propan-2-ylamino)-5-(trifluoromethyl)pyridine-3-carboxylic acid
CID 90093440
3-(1-cyclopentylpropan-2-ylamino)-1,1,1-trifluoropropan-2-ol
CID 115755879
N-(1-cyclopropylpropan-2-yl)-5-methyl-3-nitropyridin-2-amine
CID 66278519
3-chloro-N-octan-2-yl-5-(trifluoromethyl)pyridin-2-amine
CID 63540407
cis-(1S,2R)-2-N-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]cyclohexane-1,2-diamine
CID 93453945
N-(1-cyclopentylpropan-2-yl)aniline
CID 135004448

Frequently Asked Questions

What is the IUPAC name of [2-(1-cyclopentylpropan-2-ylamino)-5-(trifluoromethyl)-3-pyridinyl]methanol?
The IUPAC name of [2-(1-cyclopentylpropan-2-ylamino)-5-(trifluoromethyl)-3-pyridinyl]methanol (CID 68963290) is [2-(1-cyclopentylpropan-2-ylamino)-5-(trifluoromethyl)-3-pyridinyl]methanol.
What is the SMILES notation for [2-(1-cyclopentylpropan-2-ylamino)-5-(trifluoromethyl)-3-pyridinyl]methanol?
The canonical SMILES for [2-(1-cyclopentylpropan-2-ylamino)-5-(trifluoromethyl)-3-pyridinyl]methanol is CC(CC1CCCC1)Nc1ncc(C(F)(F)F)cc1CO.
What is the InChIKey of [2-(1-cyclopentylpropan-2-ylamino)-5-(trifluoromethyl)-3-pyridinyl]methanol?
The InChIKey is RYPYTVQRYSFCMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21F3N2O/c1-10(6-11-4-2-3-5-11)20-14-12(9-21)7-13(8-19-14)15(16,17)18/h7-8,10-11,21H,2-6,9H2,1H3,(H,19,20).
What are the key properties of [2-(1-cyclopentylpropan-2-ylamino)-5-(trifluoromethyl)-3-pyridinyl]methanol?
[2-(1-cyclopentylpropan-2-ylamino)-5-(trifluoromethyl)-3-pyridinyl]methanol has a molecular weight of 302.34 g/mol, XLogP of 3.97, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1-cyclopentylpropan-2-ylamino)-5-(trifluoromethyl)-3-pyridinyl]methanol is sourced from PubChem (CID 68963290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).