2-[(3-amino-6-methoxy-2-pyridinyl)-ethylamino]-N-propan-2-ylacetamide

C13H22N4O2 — CID 115320588

IUPAC2-[(3-amino-6-methoxy-2-pyridinyl)-ethylamino]-N-propan-2-ylacetamide
SMILESCCN(CC(=O)NC(C)C)c1nc(OC)ccc1N
InChIInChI=1S/C13H22N4O2/c1-5-17(8-11(18)15-9(2)3)13-10(14)6-7-12(16-13)19-4/h6-7,9H,5,8,14H2,1-4H3,(H,15,18)
InChIKeyORLQWPICDLVRIC-UHFFFAOYSA-N
MW266.35 g/mol
LogP1.02
Rot. Bonds6

About 2-[(3-amino-6-methoxy-2-pyridinyl)-ethylamino]-N-propan-2-ylacetamide

2-[(3-amino-6-methoxy-2-pyridinyl)-ethylamino]-N-propan-2-ylacetamide (PubChem CID 115320588) has the molecular formula C13H22N4O2 and a molecular weight of 266.35 g/mol. Its IUPAC name is 2-[(3-amino-6-methoxy-2-pyridinyl)-ethylamino]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[(3-amino-6-methoxy-2-pyridinyl)-ethylamino]-N-propan-2-ylacetamide
PubChem CID115320588
Molecular FormulaC13H22N4O2
Molecular Weight266.35 g/mol
Exact Mass266.17
IUPAC Name2-[(3-amino-6-methoxy-2-pyridinyl)-ethylamino]-N-propan-2-ylacetamide
SMILESCCN(CC(=O)NC(C)C)c1nc(OC)ccc1N
InChIInChI=1S/C13H22N4O2/c1-5-17(8-11(18)15-9(2)3)13-10(14)6-7-12(16-13)19-4/h6-7,9H,5,8,14H2,1-4H3,(H,15,18)
InChIKeyORLQWPICDLVRIC-UHFFFAOYSA-N
XLogP1.02
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.35
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(4-amino-6-methoxy-1,3,5-triazin-2-yl)-ethylamino]-N-propan-2-ylacetamide
CID 80804764
2-N-(2-ethoxyethyl)-2-N-ethyl-6-methoxypyridine-2,3-diamine
CID 113286561
2-[(3-amino-6-methoxy-2-pyridinyl)-methylamino]-N,N-dimethylacetamide
CID 113286418
2-(2-amino-6-chloro-N-ethylanilino)-N-propan-2-ylacetamide
CID 54986290
5-amino-6-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]pyridine-2-carboxylic acid
CID 114406077
2-N-[2-(dimethylamino)ethyl]-6-methoxy-2-N-(2-methylpropyl)pyridine-2,3-diamine
CID 115320620
[1-(N-(3-amino-6-methoxy-2-pyridinyl)-3,5-difluoroanilino)-1-oxopropan-2-yl]carbamic acid
CID 70922592
2-[[6-(aminomethyl)-2-pyridinyl]-ethylamino]-N-propan-2-ylacetamide
CID 64589162
6-methoxy-2-N-methyl-2-N-(2-methylbutan-2-yl)pyridine-2,3-diamine
CID 115320824
2-[(5,6-diamino-2-pyridinyl)-methylamino]-N-propan-2-ylacetamide
CID 79826827
3-amino-N-ethyl-4-methoxy-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide
CID 61115212
2-[(5-amino-6-ethoxy-2-pyridinyl)-methylamino]-N-propan-2-ylacetamide
CID 55005158

Frequently Asked Questions

What is the IUPAC name of 2-[(3-amino-6-methoxy-2-pyridinyl)-ethylamino]-N-propan-2-ylacetamide?
The IUPAC name of 2-[(3-amino-6-methoxy-2-pyridinyl)-ethylamino]-N-propan-2-ylacetamide (CID 115320588) is 2-[(3-amino-6-methoxy-2-pyridinyl)-ethylamino]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[(3-amino-6-methoxy-2-pyridinyl)-ethylamino]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[(3-amino-6-methoxy-2-pyridinyl)-ethylamino]-N-propan-2-ylacetamide is CCN(CC(=O)NC(C)C)c1nc(OC)ccc1N.
What is the InChIKey of 2-[(3-amino-6-methoxy-2-pyridinyl)-ethylamino]-N-propan-2-ylacetamide?
The InChIKey is ORLQWPICDLVRIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O2/c1-5-17(8-11(18)15-9(2)3)13-10(14)6-7-12(16-13)19-4/h6-7,9H,5,8,14H2,1-4H3,(H,15,18).
What are the key properties of 2-[(3-amino-6-methoxy-2-pyridinyl)-ethylamino]-N-propan-2-ylacetamide?
2-[(3-amino-6-methoxy-2-pyridinyl)-ethylamino]-N-propan-2-ylacetamide has a molecular weight of 266.35 g/mol, XLogP of 1.02, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-amino-6-methoxy-2-pyridinyl)-ethylamino]-N-propan-2-ylacetamide is sourced from PubChem (CID 115320588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).