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

C13H20N4O2 — CID 83107123

IUPAC4-[5-(aminomethyl)-2-pyridinyl]-N-ethylmorpholine-3-carboxamide
SMILESCCNC(=O)C1COCCN1c1ccc(CN)cn1
InChIInChI=1S/C13H20N4O2/c1-2-15-13(18)11-9-19-6-5-17(11)12-4-3-10(7-14)8-16-12/h3-4,8,11H,2,5-7,9,14H2,1H3,(H,15,18)
InChIKeyYIKGHIUFBNTNFD-UHFFFAOYSA-N
MW264.33 g/mol
LogP-0.12
Rot. Bonds4

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

4-[5-(aminomethyl)-2-pyridinyl]-N-ethylmorpholine-3-carboxamide (PubChem CID 83107123) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is 4-[5-(aminomethyl)-2-pyridinyl]-N-ethylmorpholine-3-carboxamide.

Molecular Properties

Compound Name4-[5-(aminomethyl)-2-pyridinyl]-N-ethylmorpholine-3-carboxamide
PubChem CID83107123
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC Name4-[5-(aminomethyl)-2-pyridinyl]-N-ethylmorpholine-3-carboxamide
SMILESCCNC(=O)C1COCCN1c1ccc(CN)cn1
InChIInChI=1S/C13H20N4O2/c1-2-15-13(18)11-9-19-6-5-17(11)12-4-3-10(7-14)8-16-12/h3-4,8,11H,2,5-7,9,14H2,1H3,(H,15,18)
InChIKeyYIKGHIUFBNTNFD-UHFFFAOYSA-N
XLogP-0.12
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 5-0.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-[5-(aminomethyl)-2-pyridinyl]morpholine-3-carboxamide
CID 83102569
4-[5-(aminomethyl)pyridine-2-carbonyl]-N-ethylmorpholine-3-carboxamide
CID 83096787
4-[4-(aminomethyl)-2-chlorophenyl]-N-ethylmorpholine-3-carboxamide
CID 83106357
4-[4-(aminomethyl)-2-bromophenyl]-N-ethylmorpholine-3-carboxamide
CID 83107194
6-[3-(propylcarbamoyl)morpholin-4-yl]pyridine-3-carboxylic acid
CID 83102742
N-ethyl-4-[[6-(ethylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide
CID 83105484
4-(5-amino-6-methoxy-2-pyridinyl)-N-ethylmorpholine-3-carboxamide
CID 83106690
4-(4-aminopyrimidin-2-yl)-N-ethylmorpholine-3-carboxamide
CID 116797240
4-(2-chloro-6-methylpyrimidin-4-yl)-N-ethylmorpholine-3-carboxamide
CID 83103546
4-(4-cyano-3-pyridinyl)-N-ethylmorpholine-3-carboxamide
CID 83098897
4-(6-amino-5-ethylpyrimidin-4-yl)-N-ethylmorpholine-3-carboxamide
CID 83105787
N-ethyl-4-[2-fluoro-4-(hydroxymethyl)phenyl]morpholine-3-carboxamide
CID 83102955

Frequently Asked Questions

What is the IUPAC name of 4-[5-(aminomethyl)-2-pyridinyl]-N-ethylmorpholine-3-carboxamide?
The IUPAC name of 4-[5-(aminomethyl)-2-pyridinyl]-N-ethylmorpholine-3-carboxamide (CID 83107123) is 4-[5-(aminomethyl)-2-pyridinyl]-N-ethylmorpholine-3-carboxamide.
What is the SMILES notation for 4-[5-(aminomethyl)-2-pyridinyl]-N-ethylmorpholine-3-carboxamide?
The canonical SMILES for 4-[5-(aminomethyl)-2-pyridinyl]-N-ethylmorpholine-3-carboxamide is CCNC(=O)C1COCCN1c1ccc(CN)cn1.
What is the InChIKey of 4-[5-(aminomethyl)-2-pyridinyl]-N-ethylmorpholine-3-carboxamide?
The InChIKey is YIKGHIUFBNTNFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c1-2-15-13(18)11-9-19-6-5-17(11)12-4-3-10(7-14)8-16-12/h3-4,8,11H,2,5-7,9,14H2,1H3,(H,15,18).
What are the key properties of 4-[5-(aminomethyl)-2-pyridinyl]-N-ethylmorpholine-3-carboxamide?
4-[5-(aminomethyl)-2-pyridinyl]-N-ethylmorpholine-3-carboxamide has a molecular weight of 264.33 g/mol, XLogP of -0.12, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(aminomethyl)-2-pyridinyl]-N-ethylmorpholine-3-carboxamide is sourced from PubChem (CID 83107123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).