4-N-(1-methoxypropan-2-yl)-4-N-methylpyridine-3,4-diamine

C10H17N3O — CID 61450034

IUPAC4-N-(1-methoxypropan-2-yl)-4-N-methylpyridine-3,4-diamine
SMILESCOCC(C)N(C)c1ccncc1N
InChIInChI=1S/C10H17N3O/c1-8(7-14-3)13(2)10-4-5-12-6-9(10)11/h4-6,8H,7,11H2,1-3H3
InChIKeyDIAGNWBMFRAFOI-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.13
Rot. Bonds4

About 4-N-(1-methoxypropan-2-yl)-4-N-methylpyridine-3,4-diamine

4-N-(1-methoxypropan-2-yl)-4-N-methylpyridine-3,4-diamine (PubChem CID 61450034) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 4-N-(1-methoxypropan-2-yl)-4-N-methylpyridine-3,4-diamine.

Molecular Properties

Compound Name4-N-(1-methoxypropan-2-yl)-4-N-methylpyridine-3,4-diamine
PubChem CID61450034
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name4-N-(1-methoxypropan-2-yl)-4-N-methylpyridine-3,4-diamine
SMILESCOCC(C)N(C)c1ccncc1N
InChIInChI=1S/C10H17N3O/c1-8(7-14-3)13(2)10-4-5-12-6-9(10)11/h4-6,8H,7,11H2,1-3H3
InChIKeyDIAGNWBMFRAFOI-UHFFFAOYSA-N
XLogP1.13
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-N-(1-aminopropan-2-yl)-4-N-methylpyridine-3,4-diamine
CID 82503805
2-N-(1-methoxypropan-2-yl)-2-N-methylbenzene-1,2-diamine
CID 61449915
4-N-[1-(2-methoxyphenyl)propan-2-yl]-4-N-methylpyridine-3,4-diamine
CID 65485063
4-N-(2-methoxyethyl)-4-N-methylpyridine-3,4-diamine
CID 61360000
4-N-(2-methoxyethyl)-4-N-pentan-3-ylpyridine-3,4-diamine
CID 55004103
2-[(3-amino-4-pyridinyl)-methylamino]-N,N-diethylpropanamide
CID 61359027
4-N,4-N-dimethylpyridine-3,4-diamine
CID 14088946
4-amino-3-[1-methoxypropan-2-yl(methyl)amino]benzonitrile
CID 104711661
N-(3-amino-4-pyridinyl)-N-methyl-2-phenylpropane-1-sulfonamide
CID 80691123
4-N-methyl-4-N-[2-(3-methylbutoxy)ethyl]pyridine-3,4-diamine
CID 54956565
N-(3-amino-4-pyridinyl)-N,3-dimethylbutane-1-sulfonamide
CID 63856219
5-(aminomethyl)-N-(1-methoxypropan-2-yl)-N-methylpyridin-2-amine
CID 61450095

Frequently Asked Questions

What is the IUPAC name of 4-N-(1-methoxypropan-2-yl)-4-N-methylpyridine-3,4-diamine?
The IUPAC name of 4-N-(1-methoxypropan-2-yl)-4-N-methylpyridine-3,4-diamine (CID 61450034) is 4-N-(1-methoxypropan-2-yl)-4-N-methylpyridine-3,4-diamine.
What is the SMILES notation for 4-N-(1-methoxypropan-2-yl)-4-N-methylpyridine-3,4-diamine?
The canonical SMILES for 4-N-(1-methoxypropan-2-yl)-4-N-methylpyridine-3,4-diamine is COCC(C)N(C)c1ccncc1N.
What is the InChIKey of 4-N-(1-methoxypropan-2-yl)-4-N-methylpyridine-3,4-diamine?
The InChIKey is DIAGNWBMFRAFOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-8(7-14-3)13(2)10-4-5-12-6-9(10)11/h4-6,8H,7,11H2,1-3H3.
What are the key properties of 4-N-(1-methoxypropan-2-yl)-4-N-methylpyridine-3,4-diamine?
4-N-(1-methoxypropan-2-yl)-4-N-methylpyridine-3,4-diamine has a molecular weight of 195.27 g/mol, XLogP of 1.13, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(1-methoxypropan-2-yl)-4-N-methylpyridine-3,4-diamine is sourced from PubChem (CID 61450034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).