2-[(5-methoxy-2-pyridinyl)amino]propanamide

C9H13N3O2 — CID 106503979

IUPAC2-[(5-methoxy-2-pyridinyl)amino]propanamide
SMILESCOc1ccc(NC(C)C(N)=O)nc1
InChIInChI=1S/C9H13N3O2/c1-6(9(10)13)12-8-4-3-7(14-2)5-11-8/h3-6H,1-2H3,(H2,10,13)(H,11,12)
InChIKeyKFAKZIKZVRCETG-UHFFFAOYSA-N
MW195.22 g/mol
LogP0.38
Rot. Bonds4

About 2-[(5-methoxy-2-pyridinyl)amino]propanamide

2-[(5-methoxy-2-pyridinyl)amino]propanamide (PubChem CID 106503979) has the molecular formula C9H13N3O2 and a molecular weight of 195.22 g/mol. Its IUPAC name is 2-[(5-methoxy-2-pyridinyl)amino]propanamide.

Molecular Properties

Compound Name2-[(5-methoxy-2-pyridinyl)amino]propanamide
PubChem CID106503979
Molecular FormulaC9H13N3O2
Molecular Weight195.22 g/mol
Exact Mass195.10
IUPAC Name2-[(5-methoxy-2-pyridinyl)amino]propanamide
SMILESCOc1ccc(NC(C)C(N)=O)nc1
InChIInChI=1S/C9H13N3O2/c1-6(9(10)13)12-8-4-3-7(14-2)5-11-8/h3-6H,1-2H3,(H2,10,13)(H,11,12)
InChIKeyKFAKZIKZVRCETG-UHFFFAOYSA-N
XLogP0.38
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(5-methoxy-2-pyridinyl)amino]-N-propylpropanamide
CID 106504045
2-[(5-cyano-2-pyridinyl)amino]propanamide
CID 43402789
2-N-(5-methoxy-2-pyridinyl)-3-methylbutane-1,2-diamine
CID 106504441
2-[(5-nitro-2-pyridinyl)amino]propanamide
CID 43402589
5-methoxy-N-(4-methoxybutan-2-yl)pyridin-2-amine
CID 103932146
N-[1-(4-aminophenyl)ethyl]-5-methoxypyridin-2-amine
CID 106504528
N-hexan-2-yl-5-methoxypyridin-2-amine
CID 103932159
5-methoxy-N-(4-methylsulfinylbutan-2-yl)pyridin-2-amine
CID 106504278
3-[(5-methoxy-2-pyridinyl)amino]-2-methylsulfanylbutan-1-ol
CID 104696818
N-[1-(furan-2-yl)ethyl]-5-methoxypyridin-2-amine
CID 103932113
(2R)-2-(pyrazin-2-ylamino)propanamide
CID 93037330
2-[(5-amino-6-propoxy-2-pyridinyl)amino]propanamide
CID 43545441

Frequently Asked Questions

What is the IUPAC name of 2-[(5-methoxy-2-pyridinyl)amino]propanamide?
The IUPAC name of 2-[(5-methoxy-2-pyridinyl)amino]propanamide (CID 106503979) is 2-[(5-methoxy-2-pyridinyl)amino]propanamide.
What is the SMILES notation for 2-[(5-methoxy-2-pyridinyl)amino]propanamide?
The canonical SMILES for 2-[(5-methoxy-2-pyridinyl)amino]propanamide is COc1ccc(NC(C)C(N)=O)nc1.
What is the InChIKey of 2-[(5-methoxy-2-pyridinyl)amino]propanamide?
The InChIKey is KFAKZIKZVRCETG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O2/c1-6(9(10)13)12-8-4-3-7(14-2)5-11-8/h3-6H,1-2H3,(H2,10,13)(H,11,12).
What are the key properties of 2-[(5-methoxy-2-pyridinyl)amino]propanamide?
2-[(5-methoxy-2-pyridinyl)amino]propanamide has a molecular weight of 195.22 g/mol, XLogP of 0.38, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-methoxy-2-pyridinyl)amino]propanamide is sourced from PubChem (CID 106503979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).