6-(cyclopropylmethoxy)-5-(difluoromethoxy)-N-piperidin-4-yl-N-(pyridin-3-ylmethyl)pyridin-2-amine

C21H26F2N4O2 — CID 11226128

IUPAC6-(cyclopropylmethoxy)-5-(difluoromethoxy)-N-piperidin-4-yl-N-(pyridin-3-ylmethyl)pyridin-2-amine
SMILESFC(F)Oc1ccc(N(Cc2cccnc2)C2CCNCC2)nc1OCC1CC1
InChIInChI=1S/C21H26F2N4O2/c22-21(23)29-18-5-6-19(26-20(18)28-14-15-3-4-15)27(17-7-10-24-11-8-17)13-16-2-1-9-25-12-16/h1-2,5-6,9,12,15,17,21,24H,3-4,7-8,10-11,13-14H2
InChIKeyUJGPLCQJRJTBCL-UHFFFAOYSA-N
MW404.46 g/mol
LogP3.63
Rot. Bonds9

About 6-(cyclopropylmethoxy)-5-(difluoromethoxy)-N-piperidin-4-yl-N-(pyridin-3-ylmethyl)pyridin-2-amine

6-(cyclopropylmethoxy)-5-(difluoromethoxy)-N-piperidin-4-yl-N-(pyridin-3-ylmethyl)pyridin-2-amine (PubChem CID 11226128) has the molecular formula C21H26F2N4O2 and a molecular weight of 404.46 g/mol. Its IUPAC name is 6-(cyclopropylmethoxy)-5-(difluoromethoxy)-N-piperidin-4-yl-N-(pyridin-3-ylmethyl)pyridin-2-amine.

Molecular Properties

Compound Name6-(cyclopropylmethoxy)-5-(difluoromethoxy)-N-piperidin-4-yl-N-(pyridin-3-ylmethyl)pyridin-2-amine
PubChem CID11226128
Molecular FormulaC21H26F2N4O2
Molecular Weight404.46 g/mol
Exact Mass404.20
IUPAC Name6-(cyclopropylmethoxy)-5-(difluoromethoxy)-N-piperidin-4-yl-N-(pyridin-3-ylmethyl)pyridin-2-amine
SMILESFC(F)Oc1ccc(N(Cc2cccnc2)C2CCNCC2)nc1OCC1CC1
InChIInChI=1S/C21H26F2N4O2/c22-21(23)29-18-5-6-19(26-20(18)28-14-15-3-4-15)27(17-7-10-24-11-8-17)13-16-2-1-9-25-12-16/h1-2,5-6,9,12,15,17,21,24H,3-4,7-8,10-11,13-14H2
InChIKeyUJGPLCQJRJTBCL-UHFFFAOYSA-N
XLogP3.63
TPSA59.51 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.46
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-(cyclopropylmethoxy)-5-(difluoromethoxy)-N-piperidin-4-yl-N-(pyridin-3-ylmethyl)pyridin-2-amine with MolForge

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Related Compounds

2-[[6-(cyclopropylmethoxy)-5-(difluoromethoxy)-2-pyridinyl]-(pyridin-3-ylmethyl)amino]benzoic acid
CID 143068809
tert-butyl 3-[[6-(cyclopropylmethoxy)-5-(difluoromethoxy)-2-pyridinyl]-(pyridin-3-ylmethyl)amino]benzoate
CID 91024081
N-piperidin-4-yl-N-(pyridin-3-ylmethyl)isoquinolin-6-amine
CID 59290842
3-[[6-cyclobutyloxy-5-(difluoromethoxy)-2-pyridinyl]-(pyridin-3-ylmethyl)amino]benzoic acid
CID 11487528
2-(cyclopropylmethoxy)-3-(difluoromethoxy)-6-iodopyridine
CID 87454075
N-(cyclopropylmethyl)-N-(pyridin-3-ylmethyl)azepan-4-amine
CID 143113276
N-(cyclopropylmethyl)-N-(pyridin-3-ylmethyl)piperidin-4-amine;N-(cyclopropylmethyl)-N-(pyridin-4-ylmethyl)piperidin-4-amine
CID 158216274
[3-(cyclopropylmethoxy)-4-(difluoromethoxy)phenyl]-pyridin-3-ylmethanamine
CID 68521776
6-[cyclopropyl(pyridin-3-ylmethyl)amino]pyridine-2-carboxylic acid
CID 122047885
tert-butyl 3-[[5-(difluoromethoxy)-6-propan-2-yloxy-2-pyridinyl]-(pyridin-3-ylmethyl)amino]benzoate
CID 91200726
4-(piperidin-4-ylmethoxy)-3-(trifluoromethyl)pyridine
CID 166105232
7-[3-(cyclopropylmethoxy)-2-(difluoromethoxy)phenyl]-2-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine
CID 66811172

Frequently Asked Questions

What is the IUPAC name of 6-(cyclopropylmethoxy)-5-(difluoromethoxy)-N-piperidin-4-yl-N-(pyridin-3-ylmethyl)pyridin-2-amine?
The IUPAC name of 6-(cyclopropylmethoxy)-5-(difluoromethoxy)-N-piperidin-4-yl-N-(pyridin-3-ylmethyl)pyridin-2-amine (CID 11226128) is 6-(cyclopropylmethoxy)-5-(difluoromethoxy)-N-piperidin-4-yl-N-(pyridin-3-ylmethyl)pyridin-2-amine.
What is the SMILES notation for 6-(cyclopropylmethoxy)-5-(difluoromethoxy)-N-piperidin-4-yl-N-(pyridin-3-ylmethyl)pyridin-2-amine?
The canonical SMILES for 6-(cyclopropylmethoxy)-5-(difluoromethoxy)-N-piperidin-4-yl-N-(pyridin-3-ylmethyl)pyridin-2-amine is FC(F)Oc1ccc(N(Cc2cccnc2)C2CCNCC2)nc1OCC1CC1.
What is the InChIKey of 6-(cyclopropylmethoxy)-5-(difluoromethoxy)-N-piperidin-4-yl-N-(pyridin-3-ylmethyl)pyridin-2-amine?
The InChIKey is UJGPLCQJRJTBCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26F2N4O2/c22-21(23)29-18-5-6-19(26-20(18)28-14-15-3-4-15)27(17-7-10-24-11-8-17)13-16-2-1-9-25-12-16/h1-2,5-6,9,12,15,17,21,24H,3-4,7-8,10-11,13-14H2.
What are the key properties of 6-(cyclopropylmethoxy)-5-(difluoromethoxy)-N-piperidin-4-yl-N-(pyridin-3-ylmethyl)pyridin-2-amine?
6-(cyclopropylmethoxy)-5-(difluoromethoxy)-N-piperidin-4-yl-N-(pyridin-3-ylmethyl)pyridin-2-amine has a molecular weight of 404.46 g/mol, XLogP of 3.63, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cyclopropylmethoxy)-5-(difluoromethoxy)-N-piperidin-4-yl-N-(pyridin-3-ylmethyl)pyridin-2-amine is sourced from PubChem (CID 11226128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).