2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-N-(ethylcarbamoyl)propanamide

C14H22N4O3 — CID 79782281

IUPAC2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-N-(ethylcarbamoyl)propanamide
SMILESCCNCc1ccc(OC(C)C(=O)NC(=O)NCC)cn1
InChIInChI=1S/C14H22N4O3/c1-4-15-8-11-6-7-12(9-17-11)21-10(3)13(19)18-14(20)16-5-2/h6-7,9-10,15H,4-5,8H2,1-3H3,(H2,16,18,19,20)
InChIKeyNNABVTABMQQBRH-UHFFFAOYSA-N
MW294.36 g/mol
LogP0.80
Rot. Bonds7

About 2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-N-(ethylcarbamoyl)propanamide

2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-N-(ethylcarbamoyl)propanamide (PubChem CID 79782281) has the molecular formula C14H22N4O3 and a molecular weight of 294.36 g/mol. Its IUPAC name is 2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-N-(ethylcarbamoyl)propanamide.

Molecular Properties

Compound Name2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-N-(ethylcarbamoyl)propanamide
PubChem CID79782281
Molecular FormulaC14H22N4O3
Molecular Weight294.36 g/mol
Exact Mass294.17
IUPAC Name2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-N-(ethylcarbamoyl)propanamide
SMILESCCNCc1ccc(OC(C)C(=O)NC(=O)NCC)cn1
InChIInChI=1S/C14H22N4O3/c1-4-15-8-11-6-7-12(9-17-11)21-10(3)13(19)18-14(20)16-5-2/h6-7,9-10,15H,4-5,8H2,1-3H3,(H2,16,18,19,20)
InChIKeyNNABVTABMQQBRH-UHFFFAOYSA-N
XLogP0.80
TPSA92.35 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.36
LogP ≤ 50.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-propyl-2-[[6-(propylaminomethyl)-3-pyridinyl]oxy]propanamide
CID 79783974
N-(ethylcarbamoyl)-2-(4-propan-2-ylphenoxy)propanamide
CID 60623989
N-(ethylcarbamoyl)-2-[4-[(1S)-1-hydroxyethyl]phenoxy]propanamide
CID 63364090
2-[[6-(hydroxymethyl)-3-pyridinyl]oxy]-N-(methylcarbamoyl)propanamide
CID 79799543
N-(ethylcarbamoyl)-2-[4-(hydroxymethyl)phenoxy]propanamide
CID 43082829
N-cyclopropyl-2-[[6-(propylaminomethyl)-3-pyridinyl]oxy]propanamide
CID 79782291
methyl 4-[(2S)-1-(ethylcarbamoylamino)-1-oxopropan-2-yl]oxybenzoate
CID 2103321
2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]-N-pentan-3-ylpropanamide
CID 79775506
N-(ethylcarbamoyl)-2-[4-(2-oxopropyl)phenoxy]propanamide
CID 115495454
N-carbamoyl-2-[[6-(hydroxymethyl)-3-pyridinyl]oxy]propanamide
CID 79799924
2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]propanoic acid
CID 79776211
N-[(5-but-3-en-2-yloxy-2-pyridinyl)methyl]ethanamine
CID 79775993

Frequently Asked Questions

What is the IUPAC name of 2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-N-(ethylcarbamoyl)propanamide?
The IUPAC name of 2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-N-(ethylcarbamoyl)propanamide (CID 79782281) is 2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-N-(ethylcarbamoyl)propanamide.
What is the SMILES notation for 2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-N-(ethylcarbamoyl)propanamide?
The canonical SMILES for 2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-N-(ethylcarbamoyl)propanamide is CCNCc1ccc(OC(C)C(=O)NC(=O)NCC)cn1.
What is the InChIKey of 2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-N-(ethylcarbamoyl)propanamide?
The InChIKey is NNABVTABMQQBRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O3/c1-4-15-8-11-6-7-12(9-17-11)21-10(3)13(19)18-14(20)16-5-2/h6-7,9-10,15H,4-5,8H2,1-3H3,(H2,16,18,19,20).
What are the key properties of 2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-N-(ethylcarbamoyl)propanamide?
2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-N-(ethylcarbamoyl)propanamide has a molecular weight of 294.36 g/mol, XLogP of 0.80, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-N-(ethylcarbamoyl)propanamide is sourced from PubChem (CID 79782281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).