(2R)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-2-pyrazol-1-ylpropanamide

C16H21N5O2 — CID 94037913

IUPAC(2R)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-2-pyrazol-1-ylpropanamide
SMILESC[C@H](C(=O)NCc1cccnc1N1CCOCC1)n1cccn1
InChIInChI=1S/C16H21N5O2/c1-13(21-7-3-6-19-21)16(22)18-12-14-4-2-5-17-15(14)20-8-10-23-11-9-20/h2-7,13H,8-12H2,1H3,(H,18,22)/t13-/m1/s1
InChIKeyWSIUXRXDLVEVRX-CYBMUJFWSA-N
MW315.38 g/mol
LogP0.99
Rot. Bonds5

About (2R)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-2-pyrazol-1-ylpropanamide

(2R)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-2-pyrazol-1-ylpropanamide (PubChem CID 94037913) has the molecular formula C16H21N5O2 and a molecular weight of 315.38 g/mol. Its IUPAC name is (2R)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-2-pyrazol-1-ylpropanamide.

Molecular Properties

Compound Name(2R)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-2-pyrazol-1-ylpropanamide
PubChem CID94037913
Molecular FormulaC16H21N5O2
Molecular Weight315.38 g/mol
Exact Mass315.17
IUPAC Name(2R)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-2-pyrazol-1-ylpropanamide
SMILESC[C@H](C(=O)NCc1cccnc1N1CCOCC1)n1cccn1
InChIInChI=1S/C16H21N5O2/c1-13(21-7-3-6-19-21)16(22)18-12-14-4-2-5-17-15(14)20-8-10-23-11-9-20/h2-7,13H,8-12H2,1H3,(H,18,22)/t13-/m1/s1
InChIKeyWSIUXRXDLVEVRX-CYBMUJFWSA-N
XLogP0.99
TPSA72.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.38
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-2-pyrazol-1-ylpropanamide?
The IUPAC name of (2R)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-2-pyrazol-1-ylpropanamide (CID 94037913) is (2R)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-2-pyrazol-1-ylpropanamide.
What is the SMILES notation for (2R)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-2-pyrazol-1-ylpropanamide?
The canonical SMILES for (2R)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-2-pyrazol-1-ylpropanamide is C[C@H](C(=O)NCc1cccnc1N1CCOCC1)n1cccn1.
What is the InChIKey of (2R)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-2-pyrazol-1-ylpropanamide?
The InChIKey is WSIUXRXDLVEVRX-CYBMUJFWSA-N. The full InChI is InChI=1S/C16H21N5O2/c1-13(21-7-3-6-19-21)16(22)18-12-14-4-2-5-17-15(14)20-8-10-23-11-9-20/h2-7,13H,8-12H2,1H3,(H,18,22)/t13-/m1/s1.
What are the key properties of (2R)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-2-pyrazol-1-ylpropanamide?
(2R)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-2-pyrazol-1-ylpropanamide has a molecular weight of 315.38 g/mol, XLogP of 0.99, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-2-pyrazol-1-ylpropanamide is sourced from PubChem (CID 94037913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).