4-methyl-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-6-propan-2-ylpyrimidin-2-amine

C18H25N5O — CID 136557232

IUPAC4-methyl-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-6-propan-2-ylpyrimidin-2-amine
SMILESCc1cc(C(C)C)nc(NCc2cccnc2N2CCOCC2)n1
InChIInChI=1S/C18H25N5O/c1-13(2)16-11-14(3)21-18(22-16)20-12-15-5-4-6-19-17(15)23-7-9-24-10-8-23/h4-6,11,13H,7-10,12H2,1-3H3,(H,20,21,22)
InChIKeyIOAREQUQTGTAHX-UHFFFAOYSA-N
MW327.43 g/mol
LogP2.75
Rot. Bonds5

About 4-methyl-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-6-propan-2-ylpyrimidin-2-amine

4-methyl-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-6-propan-2-ylpyrimidin-2-amine (PubChem CID 136557232) has the molecular formula C18H25N5O and a molecular weight of 327.43 g/mol. Its IUPAC name is 4-methyl-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-6-propan-2-ylpyrimidin-2-amine.

Molecular Properties

Compound Name4-methyl-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-6-propan-2-ylpyrimidin-2-amine
PubChem CID136557232
Molecular FormulaC18H25N5O
Molecular Weight327.43 g/mol
Exact Mass327.21
IUPAC Name4-methyl-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-6-propan-2-ylpyrimidin-2-amine
SMILESCc1cc(C(C)C)nc(NCc2cccnc2N2CCOCC2)n1
InChIInChI=1S/C18H25N5O/c1-13(2)16-11-14(3)21-18(22-16)20-12-15-5-4-6-19-17(15)23-7-9-24-10-8-23/h4-6,11,13H,7-10,12H2,1-3H3,(H,20,21,22)
InChIKeyIOAREQUQTGTAHX-UHFFFAOYSA-N
XLogP2.75
TPSA63.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-methyl-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-6-propan-2-ylpyrimidin-2-amine with MolForge

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Launch Full Analysis

Related Compounds

N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide
CID 38542414
2-methyl-N-[[2-(1,4-oxazepan-4-yl)-3-pyridinyl]methyl]propan-1-amine
CID 62974256
(2R)-2-methyl-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]pentanamide
CID 94045824
2-methyl-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-8-nitroquinolin-4-amine
CID 133436556
1-(2-morpholin-4-yl-3-pyridinyl)propan-2-amine
CID 83890121
1-ethyl-3-[(2-morpholin-4-yl-3-pyridinyl)methyl]urea
CID 47226420
2-methoxy-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]ethanamine
CID 114056606
4-methyl-6-morpholin-4-yl-N-(pyridin-4-ylmethyl)pyrimidin-2-amine
CID 112912080
N-[(3,5-dimethoxyphenyl)methyl]-1-(2-morpholin-4-yl-3-pyridinyl)methanamine
CID 38051168
(1S)-1-(furan-3-yl)-4-methyl-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]pentan-1-amine
CID 100705133
(1S)-1-(5-ethylfuran-2-yl)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]ethanamine
CID 97229911
(2R)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-2-pyrazol-1-ylpropanamide
CID 94037913

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-6-propan-2-ylpyrimidin-2-amine?
The IUPAC name of 4-methyl-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-6-propan-2-ylpyrimidin-2-amine (CID 136557232) is 4-methyl-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-6-propan-2-ylpyrimidin-2-amine.
What is the SMILES notation for 4-methyl-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-6-propan-2-ylpyrimidin-2-amine?
The canonical SMILES for 4-methyl-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-6-propan-2-ylpyrimidin-2-amine is Cc1cc(C(C)C)nc(NCc2cccnc2N2CCOCC2)n1.
What is the InChIKey of 4-methyl-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-6-propan-2-ylpyrimidin-2-amine?
The InChIKey is IOAREQUQTGTAHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N5O/c1-13(2)16-11-14(3)21-18(22-16)20-12-15-5-4-6-19-17(15)23-7-9-24-10-8-23/h4-6,11,13H,7-10,12H2,1-3H3,(H,20,21,22).
What are the key properties of 4-methyl-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-6-propan-2-ylpyrimidin-2-amine?
4-methyl-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-6-propan-2-ylpyrimidin-2-amine has a molecular weight of 327.43 g/mol, XLogP of 2.75, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-6-propan-2-ylpyrimidin-2-amine is sourced from PubChem (CID 136557232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).