(2S)-N-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]-N-methyl-1-pyridin-2-ylpropan-2-amine

C17H24N4O — CID 51871878

IUPAC(2S)-N-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]-N-methyl-1-pyridin-2-ylpropan-2-amine
SMILESCOCCc1ncc(CN(C)[C@@H](C)Cc2ccccn2)cn1
InChIInChI=1S/C17H24N4O/c1-14(10-16-6-4-5-8-18-16)21(2)13-15-11-19-17(20-12-15)7-9-22-3/h4-6,8,11-12,14H,7,9-10,13H2,1-3H3/t14-/m0/s1
InChIKeyZNZKFRRLDSUYDJ-AWEZNQCLSA-N
MW300.41 g/mol
LogP2.12
Rot. Bonds8

About (2S)-N-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]-N-methyl-1-pyridin-2-ylpropan-2-amine

(2S)-N-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]-N-methyl-1-pyridin-2-ylpropan-2-amine (PubChem CID 51871878) has the molecular formula C17H24N4O and a molecular weight of 300.41 g/mol. Its IUPAC name is (2S)-N-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]-N-methyl-1-pyridin-2-ylpropan-2-amine.

Molecular Properties

Compound Name(2S)-N-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]-N-methyl-1-pyridin-2-ylpropan-2-amine
PubChem CID51871878
Molecular FormulaC17H24N4O
Molecular Weight300.41 g/mol
Exact Mass300.20
IUPAC Name(2S)-N-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]-N-methyl-1-pyridin-2-ylpropan-2-amine
SMILESCOCCc1ncc(CN(C)[C@@H](C)Cc2ccccn2)cn1
InChIInChI=1S/C17H24N4O/c1-14(10-16-6-4-5-8-18-16)21(2)13-15-11-19-17(20-12-15)7-9-22-3/h4-6,8,11-12,14H,7,9-10,13H2,1-3H3/t14-/m0/s1
InChIKeyZNZKFRRLDSUYDJ-AWEZNQCLSA-N
XLogP2.12
TPSA51.14 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.41
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze (2S)-N-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]-N-methyl-1-pyridin-2-ylpropan-2-amine with MolForge

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Related Compounds

N-methyl-N-[(4-methylsulfonylphenyl)methyl]-1-pyridin-2-ylpropan-2-amine
CID 50980184
(2R)-N-[(5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl)methyl]-N-methyl-1-pyridin-2-ylpropan-2-amine
CID 95119763
5-(hydroxymethyl)-2-methyl-4-[[methyl(1-pyridin-2-ylpropan-2-yl)amino]methyl]pyridin-3-ol
CID 56721630
2-(2-chloro-4-methoxybutyl)pyridine
CID 66461980
1-N-(3-methoxypropyl)-2-N-methyl-2-N-(2-pyridin-2-ylethyl)propane-1,2-diamine
CID 62557319
ethane;N-methyl-N-(2-pyridin-2-ylethyl)propan-2-amine
CID 142585406
N-[(2,2-dimethyl-1-phenylcyclopropyl)methyl]-1-[2-(2-methoxyethyl)pyrimidin-5-yl]-N-methylmethanamine
CID 74244839
3-N-methyl-3-N-(pyridin-2-ylmethyl)butane-1,3-diamine
CID 60914164
N-(2-methoxyethyl)-2-methyl-N-(pyridin-2-ylmethyl)propanamide
CID 61242497
2-(2-propoxypropyl)pyridine
CID 121216796
(1S)-1-(4-chlorophenyl)-2-methoxy-N-methyl-N-(pyridin-2-ylmethyl)ethanamine
CID 129359313
1-(5-ethyl-2-pyridinyl)-N-methyl-4-pyridin-2-ylbutan-2-amine
CID 105168957

Frequently Asked Questions

What is the IUPAC name of (2S)-N-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]-N-methyl-1-pyridin-2-ylpropan-2-amine?
The IUPAC name of (2S)-N-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]-N-methyl-1-pyridin-2-ylpropan-2-amine (CID 51871878) is (2S)-N-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]-N-methyl-1-pyridin-2-ylpropan-2-amine.
What is the SMILES notation for (2S)-N-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]-N-methyl-1-pyridin-2-ylpropan-2-amine?
The canonical SMILES for (2S)-N-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]-N-methyl-1-pyridin-2-ylpropan-2-amine is COCCc1ncc(CN(C)[C@@H](C)Cc2ccccn2)cn1.
What is the InChIKey of (2S)-N-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]-N-methyl-1-pyridin-2-ylpropan-2-amine?
The InChIKey is ZNZKFRRLDSUYDJ-AWEZNQCLSA-N. The full InChI is InChI=1S/C17H24N4O/c1-14(10-16-6-4-5-8-18-16)21(2)13-15-11-19-17(20-12-15)7-9-22-3/h4-6,8,11-12,14H,7,9-10,13H2,1-3H3/t14-/m0/s1.
What are the key properties of (2S)-N-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]-N-methyl-1-pyridin-2-ylpropan-2-amine?
(2S)-N-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]-N-methyl-1-pyridin-2-ylpropan-2-amine has a molecular weight of 300.41 g/mol, XLogP of 2.12, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-[[2-(2-methoxyethyl)pyrimidin-5-yl]methyl]-N-methyl-1-pyridin-2-ylpropan-2-amine is sourced from PubChem (CID 51871878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).