6-[[1-[(2-ethylpyrimidin-5-yl)methyl]piperidin-4-yl]methyl]-N-(4-methyl-2-pyridinyl)pyridin-2-amine

C24H30N6 — CID 175659951

IUPAC6-[[1-[(2-ethylpyrimidin-5-yl)methyl]piperidin-4-yl]methyl]-N-(4-methyl-2-pyridinyl)pyridin-2-amine
SMILESCCc1ncc(CN2CCC(Cc3cccc(Nc4cc(C)ccn4)n3)CC2)cn1
InChIInChI=1S/C24H30N6/c1-3-22-26-15-20(16-27-22)17-30-11-8-19(9-12-30)14-21-5-4-6-23(28-21)29-24-13-18(2)7-10-25-24/h4-7,10,13,15-16,19H,3,8-9,11-12,14,17H2,1-2H3,(H,25,28,29)
InChIKeyJLAUILGBUQFSEZ-UHFFFAOYSA-N
MW402.55 g/mol
LogP4.34
Rot. Bonds7

About 6-[[1-[(2-ethylpyrimidin-5-yl)methyl]piperidin-4-yl]methyl]-N-(4-methyl-2-pyridinyl)pyridin-2-amine

6-[[1-[(2-ethylpyrimidin-5-yl)methyl]piperidin-4-yl]methyl]-N-(4-methyl-2-pyridinyl)pyridin-2-amine (PubChem CID 175659951) has the molecular formula C24H30N6 and a molecular weight of 402.55 g/mol. Its IUPAC name is 6-[[1-[(2-ethylpyrimidin-5-yl)methyl]piperidin-4-yl]methyl]-N-(4-methyl-2-pyridinyl)pyridin-2-amine.

Molecular Properties

Compound Name6-[[1-[(2-ethylpyrimidin-5-yl)methyl]piperidin-4-yl]methyl]-N-(4-methyl-2-pyridinyl)pyridin-2-amine
PubChem CID175659951
Molecular FormulaC24H30N6
Molecular Weight402.55 g/mol
Exact Mass402.25
IUPAC Name6-[[1-[(2-ethylpyrimidin-5-yl)methyl]piperidin-4-yl]methyl]-N-(4-methyl-2-pyridinyl)pyridin-2-amine
SMILESCCc1ncc(CN2CCC(Cc3cccc(Nc4cc(C)ccn4)n3)CC2)cn1
InChIInChI=1S/C24H30N6/c1-3-22-26-15-20(16-27-22)17-30-11-8-19(9-12-30)14-21-5-4-6-23(28-21)29-24-13-18(2)7-10-25-24/h4-7,10,13,15-16,19H,3,8-9,11-12,14,17H2,1-2H3,(H,25,28,29)
InChIKeyJLAUILGBUQFSEZ-UHFFFAOYSA-N
XLogP4.34
TPSA66.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.55
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-[[1-[(2-ethylpyrimidin-5-yl)methyl]piperidin-4-yl]methyl]-N-(4-methyl-2-pyridinyl)pyridin-2-amine with MolForge

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Launch Full Analysis

Related Compounds

6-[[1-[(2-ethylpyrimidin-5-yl)methyl]piperidin-4-yl]methyl]-N-pyridin-2-ylpyridin-2-amine
CID 175659323
2-[[6-[[1-[(2-ethylpyrimidin-5-yl)methyl]pyrrolidin-3-yl]methyl]-2-pyridinyl]amino]-1,3-thiazole-5-carbonitrile
CID 175659770
N-[6-[(1-pyrimidin-2-ylpiperidin-4-yl)methyl]-2-pyridinyl]pyrazin-2-amine
CID 95815305
1-[(2-ethylpyrimidin-5-yl)methyl]-N-[4-(3-methylphenyl)phenyl]piperidine-4-carboxamide
CID 26399704
N-[1-[[5-[6-[(4-methyl-2-pyridinyl)amino]-2-pyridinyl]-1,3-thiazol-2-yl]methyl]piperidin-4-yl]methanesulfonamide
CID 58706645
2-[1-[5-[6-[(4-methyl-2-pyridinyl)amino]-2-pyridinyl]-1,3-thiazol-2-yl]piperidin-4-yl]ethanol
CID 58707155
1-[4-[[6-[(5-methyl-1,2-oxazol-3-yl)amino]-2-pyridinyl]methyl]piperidin-1-yl]ethanone
CID 95815297
1-[4-[2-[5-[6-[(4-methyl-2-pyridinyl)amino]-2-pyridinyl]-1,3-thiazol-2-yl]ethyl]piperidin-1-yl]ethanone
CID 58706583
2-ethyl-5-[[(3R)-3-[6-(3-methylphenyl)-2-pyridinyl]piperidin-1-yl]methyl]pyrimidine
CID 95810588
1-[4-(4-aminopiperidin-1-yl)butyl]-4-[(4-methyl-2-pyridinyl)amino]pyrimidin-2-one
CID 137415051
N,N-dimethyl-2-[4-[[6-[(6-methyl-2-pyridinyl)amino]pyrimidin-4-yl]methyl]piperidin-1-yl]acetamide
CID 95843766
2-[1-[5-[6-[(4-methyl-2-pyridinyl)amino]-2-pyridinyl]-1,3-thiazol-2-yl]piperidin-4-yl]-N-methylsulfonylacetamide
CID 58707056

Frequently Asked Questions

What is the IUPAC name of 6-[[1-[(2-ethylpyrimidin-5-yl)methyl]piperidin-4-yl]methyl]-N-(4-methyl-2-pyridinyl)pyridin-2-amine?
The IUPAC name of 6-[[1-[(2-ethylpyrimidin-5-yl)methyl]piperidin-4-yl]methyl]-N-(4-methyl-2-pyridinyl)pyridin-2-amine (CID 175659951) is 6-[[1-[(2-ethylpyrimidin-5-yl)methyl]piperidin-4-yl]methyl]-N-(4-methyl-2-pyridinyl)pyridin-2-amine.
What is the SMILES notation for 6-[[1-[(2-ethylpyrimidin-5-yl)methyl]piperidin-4-yl]methyl]-N-(4-methyl-2-pyridinyl)pyridin-2-amine?
The canonical SMILES for 6-[[1-[(2-ethylpyrimidin-5-yl)methyl]piperidin-4-yl]methyl]-N-(4-methyl-2-pyridinyl)pyridin-2-amine is CCc1ncc(CN2CCC(Cc3cccc(Nc4cc(C)ccn4)n3)CC2)cn1.
What is the InChIKey of 6-[[1-[(2-ethylpyrimidin-5-yl)methyl]piperidin-4-yl]methyl]-N-(4-methyl-2-pyridinyl)pyridin-2-amine?
The InChIKey is JLAUILGBUQFSEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N6/c1-3-22-26-15-20(16-27-22)17-30-11-8-19(9-12-30)14-21-5-4-6-23(28-21)29-24-13-18(2)7-10-25-24/h4-7,10,13,15-16,19H,3,8-9,11-12,14,17H2,1-2H3,(H,25,28,29).
What are the key properties of 6-[[1-[(2-ethylpyrimidin-5-yl)methyl]piperidin-4-yl]methyl]-N-(4-methyl-2-pyridinyl)pyridin-2-amine?
6-[[1-[(2-ethylpyrimidin-5-yl)methyl]piperidin-4-yl]methyl]-N-(4-methyl-2-pyridinyl)pyridin-2-amine has a molecular weight of 402.55 g/mol, XLogP of 4.34, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[1-[(2-ethylpyrimidin-5-yl)methyl]piperidin-4-yl]methyl]-N-(4-methyl-2-pyridinyl)pyridin-2-amine is sourced from PubChem (CID 175659951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).