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

C23H28N6 — CID 175659323

IUPAC6-[[1-[(2-ethylpyrimidin-5-yl)methyl]piperidin-4-yl]methyl]-N-pyridin-2-ylpyridin-2-amine
SMILESCCc1ncc(CN2CCC(Cc3cccc(Nc4ccccn4)n3)CC2)cn1
InChIInChI=1S/C23H28N6/c1-2-21-25-15-19(16-26-21)17-29-12-9-18(10-13-29)14-20-6-5-8-23(27-20)28-22-7-3-4-11-24-22/h3-8,11,15-16,18H,2,9-10,12-14,17H2,1H3,(H,24,27,28)
InChIKeyNCKANWBLUKSVON-UHFFFAOYSA-N
MW388.52 g/mol
LogP4.03
Rot. Bonds7

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

6-[[1-[(2-ethylpyrimidin-5-yl)methyl]piperidin-4-yl]methyl]-N-pyridin-2-ylpyridin-2-amine (PubChem CID 175659323) has the molecular formula C23H28N6 and a molecular weight of 388.52 g/mol. Its IUPAC name is 6-[[1-[(2-ethylpyrimidin-5-yl)methyl]piperidin-4-yl]methyl]-N-pyridin-2-ylpyridin-2-amine.

Molecular Properties

Compound Name6-[[1-[(2-ethylpyrimidin-5-yl)methyl]piperidin-4-yl]methyl]-N-pyridin-2-ylpyridin-2-amine
PubChem CID175659323
Molecular FormulaC23H28N6
Molecular Weight388.52 g/mol
Exact Mass388.24
IUPAC Name6-[[1-[(2-ethylpyrimidin-5-yl)methyl]piperidin-4-yl]methyl]-N-pyridin-2-ylpyridin-2-amine
SMILESCCc1ncc(CN2CCC(Cc3cccc(Nc4ccccn4)n3)CC2)cn1
InChIInChI=1S/C23H28N6/c1-2-21-25-15-19(16-26-21)17-29-12-9-18(10-13-29)14-20-6-5-8-23(27-20)28-22-7-3-4-11-24-22/h3-8,11,15-16,18H,2,9-10,12-14,17H2,1H3,(H,24,27,28)
InChIKeyNCKANWBLUKSVON-UHFFFAOYSA-N
XLogP4.03
TPSA66.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.52
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-[[1-[(2-ethylpyrimidin-5-yl)methyl]piperidin-4-yl]methyl]-N-(4-methyl-2-pyridinyl)pyridin-2-amine
CID 175659951
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
N,N-dimethyl-2-[4-[[6-(pyridin-2-ylamino)pyrazin-2-yl]methyl]piperidin-1-yl]acetamide
CID 95815288
N-pyridin-2-yl-5-[(1-pyrimidin-2-ylpiperidin-4-yl)methyl]pyrazin-2-amine
CID 95823834
3-methoxy-1-[(3R)-3-[[6-(pyridin-2-ylamino)-2-pyridinyl]methyl]piperidin-1-yl]propan-1-one
CID 95823817
2-[[1-(2-methylpropyl)piperidin-4-yl]methyl]pyridine
CID 174571259
6-(1-oxa-8-azaspiro[4.5]decan-3-ylmethyl)-N-pyridin-2-ylpyridin-2-amine;hydrochloride
CID 171687499
2-methyl-5-[(4-pyridin-2-ylpiperidin-1-yl)methyl]pyrimidine
CID 121275152
2-[[1-(1H-imidazol-2-ylmethyl)piperidin-4-yl]methyl]pyridine
CID 95816983
(E)-3-(2-methylpyrazol-3-yl)-1-[3-[[6-(pyridin-2-ylamino)-2-pyridinyl]methyl]piperidin-1-yl]prop-2-en-1-one
CID 132778311
1-[4-[[6-[(5-methyl-1,2-oxazol-3-yl)amino]-2-pyridinyl]methyl]piperidin-1-yl]ethanone
CID 95815297

Frequently Asked Questions

What is the IUPAC name of 6-[[1-[(2-ethylpyrimidin-5-yl)methyl]piperidin-4-yl]methyl]-N-pyridin-2-ylpyridin-2-amine?
The IUPAC name of 6-[[1-[(2-ethylpyrimidin-5-yl)methyl]piperidin-4-yl]methyl]-N-pyridin-2-ylpyridin-2-amine (CID 175659323) is 6-[[1-[(2-ethylpyrimidin-5-yl)methyl]piperidin-4-yl]methyl]-N-pyridin-2-ylpyridin-2-amine.
What is the SMILES notation for 6-[[1-[(2-ethylpyrimidin-5-yl)methyl]piperidin-4-yl]methyl]-N-pyridin-2-ylpyridin-2-amine?
The canonical SMILES for 6-[[1-[(2-ethylpyrimidin-5-yl)methyl]piperidin-4-yl]methyl]-N-pyridin-2-ylpyridin-2-amine is CCc1ncc(CN2CCC(Cc3cccc(Nc4ccccn4)n3)CC2)cn1.
What is the InChIKey of 6-[[1-[(2-ethylpyrimidin-5-yl)methyl]piperidin-4-yl]methyl]-N-pyridin-2-ylpyridin-2-amine?
The InChIKey is NCKANWBLUKSVON-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N6/c1-2-21-25-15-19(16-26-21)17-29-12-9-18(10-13-29)14-20-6-5-8-23(27-20)28-22-7-3-4-11-24-22/h3-8,11,15-16,18H,2,9-10,12-14,17H2,1H3,(H,24,27,28).
What are the key properties of 6-[[1-[(2-ethylpyrimidin-5-yl)methyl]piperidin-4-yl]methyl]-N-pyridin-2-ylpyridin-2-amine?
6-[[1-[(2-ethylpyrimidin-5-yl)methyl]piperidin-4-yl]methyl]-N-pyridin-2-ylpyridin-2-amine has a molecular weight of 388.52 g/mol, XLogP of 4.03, 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-pyridin-2-ylpyridin-2-amine is sourced from PubChem (CID 175659323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).