3-methyl-N-(1-morpholin-4-ylpropan-2-yl)piperidine-3-carboxamide

C14H27N3O2 — CID 63129996

IUPAC3-methyl-N-(1-morpholin-4-ylpropan-2-yl)piperidine-3-carboxamide
SMILESCC(CN1CCOCC1)NC(=O)C1(C)CCCNC1
InChIInChI=1S/C14H27N3O2/c1-12(10-17-6-8-19-9-7-17)16-13(18)14(2)4-3-5-15-11-14/h12,15H,3-11H2,1-2H3,(H,16,18)
InChIKeyHRKGPXXJQQKKLZ-UHFFFAOYSA-N
MW269.39 g/mol
LogP0.21
Rot. Bonds4

About 3-methyl-N-(1-morpholin-4-ylpropan-2-yl)piperidine-3-carboxamide

3-methyl-N-(1-morpholin-4-ylpropan-2-yl)piperidine-3-carboxamide (PubChem CID 63129996) has the molecular formula C14H27N3O2 and a molecular weight of 269.39 g/mol. Its IUPAC name is 3-methyl-N-(1-morpholin-4-ylpropan-2-yl)piperidine-3-carboxamide.

Molecular Properties

Compound Name3-methyl-N-(1-morpholin-4-ylpropan-2-yl)piperidine-3-carboxamide
PubChem CID63129996
Molecular FormulaC14H27N3O2
Molecular Weight269.39 g/mol
Exact Mass269.21
IUPAC Name3-methyl-N-(1-morpholin-4-ylpropan-2-yl)piperidine-3-carboxamide
SMILESCC(CN1CCOCC1)NC(=O)C1(C)CCCNC1
InChIInChI=1S/C14H27N3O2/c1-12(10-17-6-8-19-9-7-17)16-13(18)14(2)4-3-5-15-11-14/h12,15H,3-11H2,1-2H3,(H,16,18)
InChIKeyHRKGPXXJQQKKLZ-UHFFFAOYSA-N
XLogP0.21
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(1-morpholin-4-ylpropan-2-yl)piperidine-3-carboxamide?
The IUPAC name of 3-methyl-N-(1-morpholin-4-ylpropan-2-yl)piperidine-3-carboxamide (CID 63129996) is 3-methyl-N-(1-morpholin-4-ylpropan-2-yl)piperidine-3-carboxamide.
What is the SMILES notation for 3-methyl-N-(1-morpholin-4-ylpropan-2-yl)piperidine-3-carboxamide?
The canonical SMILES for 3-methyl-N-(1-morpholin-4-ylpropan-2-yl)piperidine-3-carboxamide is CC(CN1CCOCC1)NC(=O)C1(C)CCCNC1.
What is the InChIKey of 3-methyl-N-(1-morpholin-4-ylpropan-2-yl)piperidine-3-carboxamide?
The InChIKey is HRKGPXXJQQKKLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O2/c1-12(10-17-6-8-19-9-7-17)16-13(18)14(2)4-3-5-15-11-14/h12,15H,3-11H2,1-2H3,(H,16,18).
What are the key properties of 3-methyl-N-(1-morpholin-4-ylpropan-2-yl)piperidine-3-carboxamide?
3-methyl-N-(1-morpholin-4-ylpropan-2-yl)piperidine-3-carboxamide has a molecular weight of 269.39 g/mol, XLogP of 0.21, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(1-morpholin-4-ylpropan-2-yl)piperidine-3-carboxamide is sourced from PubChem (CID 63129996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).