N'-[1-(2-methoxy-3-pyridinyl)propan-2-yl]ethane-1,2-diamine

C11H19N3O — CID 67241279

IUPACN'-[1-(2-methoxy-3-pyridinyl)propan-2-yl]ethane-1,2-diamine
SMILESCOc1ncccc1CC(C)NCCN
InChIInChI=1S/C11H19N3O/c1-9(13-7-5-12)8-10-4-3-6-14-11(10)15-2/h3-4,6,9,13H,5,7-8,12H2,1-2H3
InChIKeySJWVELFYMUGKFH-UHFFFAOYSA-N
MW209.29 g/mol
LogP0.57
Rot. Bonds6

About N'-[1-(2-methoxy-3-pyridinyl)propan-2-yl]ethane-1,2-diamine

N'-[1-(2-methoxy-3-pyridinyl)propan-2-yl]ethane-1,2-diamine (PubChem CID 67241279) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is N'-[1-(2-methoxy-3-pyridinyl)propan-2-yl]ethane-1,2-diamine.

Molecular Properties

Compound NameN'-[1-(2-methoxy-3-pyridinyl)propan-2-yl]ethane-1,2-diamine
PubChem CID67241279
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC NameN'-[1-(2-methoxy-3-pyridinyl)propan-2-yl]ethane-1,2-diamine
SMILESCOc1ncccc1CC(C)NCCN
InChIInChI=1S/C11H19N3O/c1-9(13-7-5-12)8-10-4-3-6-14-11(10)15-2/h3-4,6,9,13H,5,7-8,12H2,1-2H3
InChIKeySJWVELFYMUGKFH-UHFFFAOYSA-N
XLogP0.57
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2-methoxy-3-pyridinyl)methanamine;hydrochloride
CID 71627038
N'-[(2-methoxy-3-pyridinyl)methyl]propane-1,3-diamine
CID 21271684
3-(2-methoxy-3-pyridinyl)propan-1-amine
CID 55266989
(2S)-N-[(2-methoxy-3-pyridinyl)methyl]-3-methylbutan-2-amine
CID 93316993
N-[(2-methoxy-3-pyridinyl)methyl]-3-methylbutan-2-amine
CID 60860137
2-N-[(2-methoxy-3-pyridinyl)methyl]-1-N,1-N-dimethylpropane-1,2-diamine
CID 82939229
2-N-(2-methoxy-3-pyridinyl)propane-1,2-diamine
CID 103388537
(1S)-N-[(2-methoxy-3-pyridinyl)methyl]-1-pyridin-4-ylethanamine
CID 81409770
O-[2-(2-methoxy-3-pyridinyl)ethyl]hydroxylamine
CID 70307544
(2S)-1-[(2-methoxy-3-pyridinyl)methylamino]propan-2-ol
CID 106931879
1-(2-methoxy-3-pyridinyl)-N-(2-methylpropoxy)methanamine
CID 82714723
2-methoxy-3-(methoxymethyl)pyridine
CID 67266398

Frequently Asked Questions

What is the IUPAC name of N'-[1-(2-methoxy-3-pyridinyl)propan-2-yl]ethane-1,2-diamine?
The IUPAC name of N'-[1-(2-methoxy-3-pyridinyl)propan-2-yl]ethane-1,2-diamine (CID 67241279) is N'-[1-(2-methoxy-3-pyridinyl)propan-2-yl]ethane-1,2-diamine.
What is the SMILES notation for N'-[1-(2-methoxy-3-pyridinyl)propan-2-yl]ethane-1,2-diamine?
The canonical SMILES for N'-[1-(2-methoxy-3-pyridinyl)propan-2-yl]ethane-1,2-diamine is COc1ncccc1CC(C)NCCN.
What is the InChIKey of N'-[1-(2-methoxy-3-pyridinyl)propan-2-yl]ethane-1,2-diamine?
The InChIKey is SJWVELFYMUGKFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-9(13-7-5-12)8-10-4-3-6-14-11(10)15-2/h3-4,6,9,13H,5,7-8,12H2,1-2H3.
What are the key properties of N'-[1-(2-methoxy-3-pyridinyl)propan-2-yl]ethane-1,2-diamine?
N'-[1-(2-methoxy-3-pyridinyl)propan-2-yl]ethane-1,2-diamine has a molecular weight of 209.29 g/mol, XLogP of 0.57, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[1-(2-methoxy-3-pyridinyl)propan-2-yl]ethane-1,2-diamine is sourced from PubChem (CID 67241279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).