4-[5-(aminomethyl)pyridine-2-carbonyl]-N-ethylmorpholine-3-carboxamide

C14H20N4O3 — CID 83096787

IUPAC4-[5-(aminomethyl)pyridine-2-carbonyl]-N-ethylmorpholine-3-carboxamide
SMILESCCNC(=O)C1COCCN1C(=O)c1ccc(CN)cn1
InChIInChI=1S/C14H20N4O3/c1-2-16-13(19)12-9-21-6-5-18(12)14(20)11-4-3-10(7-15)8-17-11/h3-4,8,12H,2,5-7,9,15H2,1H3,(H,16,19)
InChIKeyORNDIURXKODRPM-UHFFFAOYSA-N
MW292.34 g/mol
LogP-0.48
Rot. Bonds4

About 4-[5-(aminomethyl)pyridine-2-carbonyl]-N-ethylmorpholine-3-carboxamide

4-[5-(aminomethyl)pyridine-2-carbonyl]-N-ethylmorpholine-3-carboxamide (PubChem CID 83096787) has the molecular formula C14H20N4O3 and a molecular weight of 292.34 g/mol. Its IUPAC name is 4-[5-(aminomethyl)pyridine-2-carbonyl]-N-ethylmorpholine-3-carboxamide.

Molecular Properties

Compound Name4-[5-(aminomethyl)pyridine-2-carbonyl]-N-ethylmorpholine-3-carboxamide
PubChem CID83096787
Molecular FormulaC14H20N4O3
Molecular Weight292.34 g/mol
Exact Mass292.15
IUPAC Name4-[5-(aminomethyl)pyridine-2-carbonyl]-N-ethylmorpholine-3-carboxamide
SMILESCCNC(=O)C1COCCN1C(=O)c1ccc(CN)cn1
InChIInChI=1S/C14H20N4O3/c1-2-16-13(19)12-9-21-6-5-18(12)14(20)11-4-3-10(7-15)8-17-11/h3-4,8,12H,2,5-7,9,15H2,1H3,(H,16,19)
InChIKeyORNDIURXKODRPM-UHFFFAOYSA-N
XLogP-0.48
TPSA97.55 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 5-0.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-[5-(aminomethyl)-2-pyridinyl]-N-ethylmorpholine-3-carboxamide
CID 83107123
4-[2-(aminomethyl)pyridine-4-carbonyl]-N-ethylmorpholine-3-carboxamide
CID 83098199
4-(5-bromopyridine-2-carbonyl)-N-methylmorpholine-3-carboxamide
CID 83100375
[5-(aminomethyl)-2-pyridinyl]-morpholin-4-ylmethanone
CID 63723014
4-(2,5-dichloropyridine-4-carbonyl)-N-ethylmorpholine-3-carboxamide
CID 114918798
4-(3-amino-4-fluorobenzoyl)-N-ethylmorpholine-3-carboxamide
CID 83099381
N-ethyl-4-[[6-(ethylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide
CID 83105484
4-(4-amino-1-ethylpyrazole-5-carbonyl)-N-ethylmorpholine-3-carboxamide
CID 83099384
3-N-ethylmorpholine-3,4-dicarboxamide
CID 83106248
4-[4-(aminomethyl)-2-chlorophenyl]-N-ethylmorpholine-3-carboxamide
CID 83106357
6-(3-carbamoylmorpholine-4-carbonyl)pyridine-3-carboxylic acid
CID 83096346
4-[3-(chloromethyl)benzoyl]-N-ethylmorpholine-3-carboxamide
CID 83098794

Frequently Asked Questions

What is the IUPAC name of 4-[5-(aminomethyl)pyridine-2-carbonyl]-N-ethylmorpholine-3-carboxamide?
The IUPAC name of 4-[5-(aminomethyl)pyridine-2-carbonyl]-N-ethylmorpholine-3-carboxamide (CID 83096787) is 4-[5-(aminomethyl)pyridine-2-carbonyl]-N-ethylmorpholine-3-carboxamide.
What is the SMILES notation for 4-[5-(aminomethyl)pyridine-2-carbonyl]-N-ethylmorpholine-3-carboxamide?
The canonical SMILES for 4-[5-(aminomethyl)pyridine-2-carbonyl]-N-ethylmorpholine-3-carboxamide is CCNC(=O)C1COCCN1C(=O)c1ccc(CN)cn1.
What is the InChIKey of 4-[5-(aminomethyl)pyridine-2-carbonyl]-N-ethylmorpholine-3-carboxamide?
The InChIKey is ORNDIURXKODRPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O3/c1-2-16-13(19)12-9-21-6-5-18(12)14(20)11-4-3-10(7-15)8-17-11/h3-4,8,12H,2,5-7,9,15H2,1H3,(H,16,19).
What are the key properties of 4-[5-(aminomethyl)pyridine-2-carbonyl]-N-ethylmorpholine-3-carboxamide?
4-[5-(aminomethyl)pyridine-2-carbonyl]-N-ethylmorpholine-3-carboxamide has a molecular weight of 292.34 g/mol, XLogP of -0.48, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(aminomethyl)pyridine-2-carbonyl]-N-ethylmorpholine-3-carboxamide is sourced from PubChem (CID 83096787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).