2-(1-methoxypropan-2-yl)-1H-pyridine-2,3-diamine

C9H17N3O — CID 154455038

IUPAC2-(1-methoxypropan-2-yl)-1H-pyridine-2,3-diamine
SMILESCOCC(C)C1(N)NC=CC=C1N
InChIInChI=1S/C9H17N3O/c1-7(6-13-2)9(11)8(10)4-3-5-12-9/h3-5,7,12H,6,10-11H2,1-2H3
InChIKeyYHUKDANYEPYLBM-UHFFFAOYSA-N
MW183.25 g/mol
LogP-0.12
Rot. Bonds3

About 2-(1-methoxypropan-2-yl)-1H-pyridine-2,3-diamine

2-(1-methoxypropan-2-yl)-1H-pyridine-2,3-diamine (PubChem CID 154455038) has the molecular formula C9H17N3O and a molecular weight of 183.25 g/mol. Its IUPAC name is 2-(1-methoxypropan-2-yl)-1H-pyridine-2,3-diamine.

Molecular Properties

Compound Name2-(1-methoxypropan-2-yl)-1H-pyridine-2,3-diamine
PubChem CID154455038
Molecular FormulaC9H17N3O
Molecular Weight183.25 g/mol
Exact Mass183.14
IUPAC Name2-(1-methoxypropan-2-yl)-1H-pyridine-2,3-diamine
SMILESCOCC(C)C1(N)NC=CC=C1N
InChIInChI=1S/C9H17N3O/c1-7(6-13-2)9(11)8(10)4-3-5-12-9/h3-5,7,12H,6,10-11H2,1-2H3
InChIKeyYHUKDANYEPYLBM-UHFFFAOYSA-N
XLogP-0.12
TPSA73.30 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 5-0.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1-methoxypropan-2-yl)-1H-pyridine-2,5-diamine
CID 67535619
2-(2-methoxyethyl)-1H-pyridine-2,5-diamine
CID 67537038
2-(2-methoxyethyl)-1H-pyridine-2,4-diamine
CID 68547041
2-[(2R)-1-methoxypentan-2-yl]-1H-pyridine-2,3-diamine
CID 124140256
2-(oxan-4-yl)-1H-pyridine-2,5-diamine
CID 142494340
2-(oxetan-3-yl)-1H-pyridine-2,5-diamine
CID 152184936
2-(3-methoxypropyl)-2-N-methyl-1H-pyridine-2,5-diamine
CID 152574327
2-(2-methoxyethyl)-2-N-methyl-1H-pyridine-2,5-diamine
CID 154124773
2-(3-methoxypropyl)-1H-pyridine-2,5-diamine
CID 154193878
2-(oxan-4-yl)-1H-pyridine-2,3-diamine
CID 154207529
2-(1-methoxybutan-2-yl)-1H-pyridine-2,3-diamine
CID 154455033
2-(4-methoxybutan-2-yl)-1H-azepine
CID 174311560

Frequently Asked Questions

What is the IUPAC name of 2-(1-methoxypropan-2-yl)-1H-pyridine-2,3-diamine?
The IUPAC name of 2-(1-methoxypropan-2-yl)-1H-pyridine-2,3-diamine (CID 154455038) is 2-(1-methoxypropan-2-yl)-1H-pyridine-2,3-diamine.
What is the SMILES notation for 2-(1-methoxypropan-2-yl)-1H-pyridine-2,3-diamine?
The canonical SMILES for 2-(1-methoxypropan-2-yl)-1H-pyridine-2,3-diamine is COCC(C)C1(N)NC=CC=C1N.
What is the InChIKey of 2-(1-methoxypropan-2-yl)-1H-pyridine-2,3-diamine?
The InChIKey is YHUKDANYEPYLBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O/c1-7(6-13-2)9(11)8(10)4-3-5-12-9/h3-5,7,12H,6,10-11H2,1-2H3.
What are the key properties of 2-(1-methoxypropan-2-yl)-1H-pyridine-2,3-diamine?
2-(1-methoxypropan-2-yl)-1H-pyridine-2,3-diamine has a molecular weight of 183.25 g/mol, XLogP of -0.12, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methoxypropan-2-yl)-1H-pyridine-2,3-diamine is sourced from PubChem (CID 154455038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).