N,N-dimethyl-6-[(2R)-4-[(2-propan-2-ylpyrazol-3-yl)methyl]morpholin-2-yl]pyridin-2-amine

C18H27N5O — CID 124980154

IUPACN,N-dimethyl-6-[(2R)-4-[(2-propan-2-ylpyrazol-3-yl)methyl]morpholin-2-yl]pyridin-2-amine
SMILESCC(C)n1nccc1CN1CCO[C@@H](c2cccc(N(C)C)n2)C1
InChIInChI=1S/C18H27N5O/c1-14(2)23-15(8-9-19-23)12-22-10-11-24-17(13-22)16-6-5-7-18(20-16)21(3)4/h5-9,14,17H,10-13H2,1-4H3/t17-/m1/s1
InChIKeyMGPZLWUZKQFFLE-QGZVFWFLSA-N
MW329.45 g/mol
LogP2.50
Rot. Bonds5

About N,N-dimethyl-6-[(2R)-4-[(2-propan-2-ylpyrazol-3-yl)methyl]morpholin-2-yl]pyridin-2-amine

N,N-dimethyl-6-[(2R)-4-[(2-propan-2-ylpyrazol-3-yl)methyl]morpholin-2-yl]pyridin-2-amine (PubChem CID 124980154) has the molecular formula C18H27N5O and a molecular weight of 329.45 g/mol. Its IUPAC name is N,N-dimethyl-6-[(2R)-4-[(2-propan-2-ylpyrazol-3-yl)methyl]morpholin-2-yl]pyridin-2-amine.

Molecular Properties

Compound NameN,N-dimethyl-6-[(2R)-4-[(2-propan-2-ylpyrazol-3-yl)methyl]morpholin-2-yl]pyridin-2-amine
PubChem CID124980154
Molecular FormulaC18H27N5O
Molecular Weight329.45 g/mol
Exact Mass329.22
IUPAC NameN,N-dimethyl-6-[(2R)-4-[(2-propan-2-ylpyrazol-3-yl)methyl]morpholin-2-yl]pyridin-2-amine
SMILESCC(C)n1nccc1CN1CCO[C@@H](c2cccc(N(C)C)n2)C1
InChIInChI=1S/C18H27N5O/c1-14(2)23-15(8-9-19-23)12-22-10-11-24-17(13-22)16-6-5-7-18(20-16)21(3)4/h5-9,14,17H,10-13H2,1-4H3/t17-/m1/s1
InChIKeyMGPZLWUZKQFFLE-QGZVFWFLSA-N
XLogP2.50
TPSA46.42 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.45
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-6-[(2R)-4-[(2-propan-2-ylpyrazol-3-yl)methyl]morpholin-2-yl]pyridin-2-amine?
The IUPAC name of N,N-dimethyl-6-[(2R)-4-[(2-propan-2-ylpyrazol-3-yl)methyl]morpholin-2-yl]pyridin-2-amine (CID 124980154) is N,N-dimethyl-6-[(2R)-4-[(2-propan-2-ylpyrazol-3-yl)methyl]morpholin-2-yl]pyridin-2-amine.
What is the SMILES notation for N,N-dimethyl-6-[(2R)-4-[(2-propan-2-ylpyrazol-3-yl)methyl]morpholin-2-yl]pyridin-2-amine?
The canonical SMILES for N,N-dimethyl-6-[(2R)-4-[(2-propan-2-ylpyrazol-3-yl)methyl]morpholin-2-yl]pyridin-2-amine is CC(C)n1nccc1CN1CCO[C@@H](c2cccc(N(C)C)n2)C1.
What is the InChIKey of N,N-dimethyl-6-[(2R)-4-[(2-propan-2-ylpyrazol-3-yl)methyl]morpholin-2-yl]pyridin-2-amine?
The InChIKey is MGPZLWUZKQFFLE-QGZVFWFLSA-N. The full InChI is InChI=1S/C18H27N5O/c1-14(2)23-15(8-9-19-23)12-22-10-11-24-17(13-22)16-6-5-7-18(20-16)21(3)4/h5-9,14,17H,10-13H2,1-4H3/t17-/m1/s1.
What are the key properties of N,N-dimethyl-6-[(2R)-4-[(2-propan-2-ylpyrazol-3-yl)methyl]morpholin-2-yl]pyridin-2-amine?
N,N-dimethyl-6-[(2R)-4-[(2-propan-2-ylpyrazol-3-yl)methyl]morpholin-2-yl]pyridin-2-amine has a molecular weight of 329.45 g/mol, XLogP of 2.50, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-6-[(2R)-4-[(2-propan-2-ylpyrazol-3-yl)methyl]morpholin-2-yl]pyridin-2-amine is sourced from PubChem (CID 124980154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).