N-[(2-morpholin-4-yl-4-pyridinyl)methyl]butanamide

C14H21N3O2 — CID 32585359

IUPACN-[(2-morpholin-4-yl-4-pyridinyl)methyl]butanamide
SMILESCCCC(=O)NCc1ccnc(N2CCOCC2)c1
InChIInChI=1S/C14H21N3O2/c1-2-3-14(18)16-11-12-4-5-15-13(10-12)17-6-8-19-9-7-17/h4-5,10H,2-3,6-9,11H2,1H3,(H,16,18)
InChIKeyCUDFDERQAFMJIU-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.33
Rot. Bonds5

About N-[(2-morpholin-4-yl-4-pyridinyl)methyl]butanamide

N-[(2-morpholin-4-yl-4-pyridinyl)methyl]butanamide (PubChem CID 32585359) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-[(2-morpholin-4-yl-4-pyridinyl)methyl]butanamide.

Molecular Properties

Compound NameN-[(2-morpholin-4-yl-4-pyridinyl)methyl]butanamide
PubChem CID32585359
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC NameN-[(2-morpholin-4-yl-4-pyridinyl)methyl]butanamide
SMILESCCCC(=O)NCc1ccnc(N2CCOCC2)c1
InChIInChI=1S/C14H21N3O2/c1-2-3-14(18)16-11-12-4-5-15-13(10-12)17-6-8-19-9-7-17/h4-5,10H,2-3,6-9,11H2,1H3,(H,16,18)
InChIKeyCUDFDERQAFMJIU-UHFFFAOYSA-N
XLogP1.33
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(2-morpholin-4-yl-4-pyridinyl)methyl]butanamide?
The IUPAC name of N-[(2-morpholin-4-yl-4-pyridinyl)methyl]butanamide (CID 32585359) is N-[(2-morpholin-4-yl-4-pyridinyl)methyl]butanamide.
What is the SMILES notation for N-[(2-morpholin-4-yl-4-pyridinyl)methyl]butanamide?
The canonical SMILES for N-[(2-morpholin-4-yl-4-pyridinyl)methyl]butanamide is CCCC(=O)NCc1ccnc(N2CCOCC2)c1.
What is the InChIKey of N-[(2-morpholin-4-yl-4-pyridinyl)methyl]butanamide?
The InChIKey is CUDFDERQAFMJIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-2-3-14(18)16-11-12-4-5-15-13(10-12)17-6-8-19-9-7-17/h4-5,10H,2-3,6-9,11H2,1H3,(H,16,18).
What are the key properties of N-[(2-morpholin-4-yl-4-pyridinyl)methyl]butanamide?
N-[(2-morpholin-4-yl-4-pyridinyl)methyl]butanamide has a molecular weight of 263.34 g/mol, XLogP of 1.33, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-morpholin-4-yl-4-pyridinyl)methyl]butanamide is sourced from PubChem (CID 32585359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).