4-[[4-(methylamino)-2-pyridinyl]methyl]-N-propan-2-ylmorpholine-3-carboxamide

C15H24N4O2 — CID 83105350

IUPAC4-[[4-(methylamino)-2-pyridinyl]methyl]-N-propan-2-ylmorpholine-3-carboxamide
SMILESCNc1ccnc(CN2CCOCC2C(=O)NC(C)C)c1
InChIInChI=1S/C15H24N4O2/c1-11(2)18-15(20)14-10-21-7-6-19(14)9-13-8-12(16-3)4-5-17-13/h4-5,8,11,14H,6-7,9-10H2,1-3H3,(H,16,17)(H,18,20)
InChIKeyFDFPTQOBRRCXMA-UHFFFAOYSA-N
MW292.38 g/mol
LogP0.85
Rot. Bonds5

About 4-[[4-(methylamino)-2-pyridinyl]methyl]-N-propan-2-ylmorpholine-3-carboxamide

4-[[4-(methylamino)-2-pyridinyl]methyl]-N-propan-2-ylmorpholine-3-carboxamide (PubChem CID 83105350) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is 4-[[4-(methylamino)-2-pyridinyl]methyl]-N-propan-2-ylmorpholine-3-carboxamide.

Molecular Properties

Compound Name4-[[4-(methylamino)-2-pyridinyl]methyl]-N-propan-2-ylmorpholine-3-carboxamide
PubChem CID83105350
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Name4-[[4-(methylamino)-2-pyridinyl]methyl]-N-propan-2-ylmorpholine-3-carboxamide
SMILESCNc1ccnc(CN2CCOCC2C(=O)NC(C)C)c1
InChIInChI=1S/C15H24N4O2/c1-11(2)18-15(20)14-10-21-7-6-19(14)9-13-8-12(16-3)4-5-17-13/h4-5,8,11,14H,6-7,9-10H2,1-3H3,(H,16,17)(H,18,20)
InChIKeyFDFPTQOBRRCXMA-UHFFFAOYSA-N
XLogP0.85
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[[4-(methylamino)-2-pyridinyl]methyl]-N-propan-2-ylmorpholine-3-carboxamide?
The IUPAC name of 4-[[4-(methylamino)-2-pyridinyl]methyl]-N-propan-2-ylmorpholine-3-carboxamide (CID 83105350) is 4-[[4-(methylamino)-2-pyridinyl]methyl]-N-propan-2-ylmorpholine-3-carboxamide.
What is the SMILES notation for 4-[[4-(methylamino)-2-pyridinyl]methyl]-N-propan-2-ylmorpholine-3-carboxamide?
The canonical SMILES for 4-[[4-(methylamino)-2-pyridinyl]methyl]-N-propan-2-ylmorpholine-3-carboxamide is CNc1ccnc(CN2CCOCC2C(=O)NC(C)C)c1.
What is the InChIKey of 4-[[4-(methylamino)-2-pyridinyl]methyl]-N-propan-2-ylmorpholine-3-carboxamide?
The InChIKey is FDFPTQOBRRCXMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-11(2)18-15(20)14-10-21-7-6-19(14)9-13-8-12(16-3)4-5-17-13/h4-5,8,11,14H,6-7,9-10H2,1-3H3,(H,16,17)(H,18,20).
What are the key properties of 4-[[4-(methylamino)-2-pyridinyl]methyl]-N-propan-2-ylmorpholine-3-carboxamide?
4-[[4-(methylamino)-2-pyridinyl]methyl]-N-propan-2-ylmorpholine-3-carboxamide has a molecular weight of 292.38 g/mol, XLogP of 0.85, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[4-(methylamino)-2-pyridinyl]methyl]-N-propan-2-ylmorpholine-3-carboxamide is sourced from PubChem (CID 83105350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).