4-[[2-(propylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide

C14H22N4O2 — CID 83095743

IUPAC4-[[2-(propylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide
SMILESCCCNc1ncccc1CN1CCOCC1C(N)=O
InChIInChI=1S/C14H22N4O2/c1-2-5-16-14-11(4-3-6-17-14)9-18-7-8-20-10-12(18)13(15)19/h3-4,6,12H,2,5,7-10H2,1H3,(H2,15,19)(H,16,17)
InChIKeySBWGOKABYWCBRA-UHFFFAOYSA-N
MW278.36 g/mol
LogP0.59
Rot. Bonds6

About 4-[[2-(propylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide

4-[[2-(propylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide (PubChem CID 83095743) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is 4-[[2-(propylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide.

Molecular Properties

Compound Name4-[[2-(propylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide
PubChem CID83095743
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC Name4-[[2-(propylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide
SMILESCCCNc1ncccc1CN1CCOCC1C(N)=O
InChIInChI=1S/C14H22N4O2/c1-2-5-16-14-11(4-3-6-17-14)9-18-7-8-20-10-12(18)13(15)19/h3-4,6,12H,2,5,7-10H2,1H3,(H2,15,19)(H,16,17)
InChIKeySBWGOKABYWCBRA-UHFFFAOYSA-N
XLogP0.59
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-[[2-(ethylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide
CID 83095840
1-[[2-(propylamino)-3-pyridinyl]methyl]pyrrolidine-2-carboxamide
CID 62470053
N-ethyl-4-[[2-(methylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide
CID 83103290
4-[[2-(propylamino)-4-pyridinyl]methyl]morpholine-3-carboxamide
CID 83096353
4-[(2-chloro-3-pyridinyl)methyl]-N-propylmorpholine-3-carboxamide
CID 83099400
methyl 1-[[2-(propylamino)-3-pyridinyl]methyl]pyrrolidine-2-carboxylate
CID 62471191
4-[(5-aminoquinolin-8-yl)methyl]morpholine-3-carboxamide
CID 83096763
1-[4-[[2-(propylamino)-3-pyridinyl]methyl]piperazin-1-yl]ethanone
CID 62470561
4-[(2-cyanophenyl)methyl]morpholine-3-carboxamide
CID 83092917
4-(pyridin-4-ylmethyl)morpholine-3-carboxamide
CID 132970427
N-propyl-3-(pyrrolidin-1-ylmethyl)pyridin-2-amine
CID 62470751
4-[[2-(3-aminoprop-1-ynyl)phenyl]methyl]morpholine-3-carboxamide
CID 83095375

Frequently Asked Questions

What is the IUPAC name of 4-[[2-(propylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide?
The IUPAC name of 4-[[2-(propylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide (CID 83095743) is 4-[[2-(propylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide.
What is the SMILES notation for 4-[[2-(propylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide?
The canonical SMILES for 4-[[2-(propylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide is CCCNc1ncccc1CN1CCOCC1C(N)=O.
What is the InChIKey of 4-[[2-(propylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide?
The InChIKey is SBWGOKABYWCBRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2/c1-2-5-16-14-11(4-3-6-17-14)9-18-7-8-20-10-12(18)13(15)19/h3-4,6,12H,2,5,7-10H2,1H3,(H2,15,19)(H,16,17).
What are the key properties of 4-[[2-(propylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide?
4-[[2-(propylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide has a molecular weight of 278.36 g/mol, XLogP of 0.59, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-(propylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide is sourced from PubChem (CID 83095743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).