N'-methyl-N-propan-2-yl-N'-pyridin-3-ylethane-1,2-diamine

C11H19N3 — CID 115206418

IUPACN'-methyl-N-propan-2-yl-N'-pyridin-3-ylethane-1,2-diamine
SMILESCC(C)NCCN(C)c1cccnc1
InChIInChI=1S/C11H19N3/c1-10(2)13-7-8-14(3)11-5-4-6-12-9-11/h4-6,9-10,13H,7-8H2,1-3H3
InChIKeyXMGCDKQAZMKFLW-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.52
Rot. Bonds5

About N'-methyl-N-propan-2-yl-N'-pyridin-3-ylethane-1,2-diamine

N'-methyl-N-propan-2-yl-N'-pyridin-3-ylethane-1,2-diamine (PubChem CID 115206418) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is N'-methyl-N-propan-2-yl-N'-pyridin-3-ylethane-1,2-diamine.

Molecular Properties

Compound NameN'-methyl-N-propan-2-yl-N'-pyridin-3-ylethane-1,2-diamine
PubChem CID115206418
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC NameN'-methyl-N-propan-2-yl-N'-pyridin-3-ylethane-1,2-diamine
SMILESCC(C)NCCN(C)c1cccnc1
InChIInChI=1S/C11H19N3/c1-10(2)13-7-8-14(3)11-5-4-6-12-9-11/h4-6,9-10,13H,7-8H2,1-3H3
InChIKeyXMGCDKQAZMKFLW-UHFFFAOYSA-N
XLogP1.52
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N'-(4-chlorophenyl)-N'-methyl-N-propan-2-ylethane-1,2-diamine
CID 115206325
N-methyl-2-[(propan-2-ylamino)methyl]-N-(pyridin-3-ylmethyl)pyridin-4-amine
CID 62282233
3-methyl-2-[[methyl(pyridin-3-yl)amino]methyl]butanenitrile
CID 115254409
3-methyl-2-[[methyl(pyridin-3-yl)amino]methyl]butan-1-ol
CID 115251995
3-[1-[[methyl-[3-(propan-2-ylamino)propyl]sulfamoyl]amino]ethyl]pyridine
CID 106021144
N-methyl-N-(3-piperazin-1-ylbutyl)pyridin-3-amine
CID 115255466
N'-(5-chloro-2-pyridinyl)-N'-methyl-N-propan-2-ylethane-1,2-diamine
CID 62585670
N-(2-methyl-2-pyridin-3-ylpropyl)-N'-propan-2-ylethane-1,2-diamine
CID 115206679
3,3-dimethyl-N-propan-2-yl-4-pyridin-3-ylbutan-1-amine
CID 104737370
N-[2-(propan-2-ylamino)ethyl]pyridine-3-carboxamide
CID 4235481
N'-(4-methoxypyrimidin-2-yl)-N'-methyl-N-propan-2-ylethane-1,2-diamine
CID 62586031
N,N-dimethylpyridin-3-amine;hydrochloride
CID 23028557

Frequently Asked Questions

What is the IUPAC name of N'-methyl-N-propan-2-yl-N'-pyridin-3-ylethane-1,2-diamine?
The IUPAC name of N'-methyl-N-propan-2-yl-N'-pyridin-3-ylethane-1,2-diamine (CID 115206418) is N'-methyl-N-propan-2-yl-N'-pyridin-3-ylethane-1,2-diamine.
What is the SMILES notation for N'-methyl-N-propan-2-yl-N'-pyridin-3-ylethane-1,2-diamine?
The canonical SMILES for N'-methyl-N-propan-2-yl-N'-pyridin-3-ylethane-1,2-diamine is CC(C)NCCN(C)c1cccnc1.
What is the InChIKey of N'-methyl-N-propan-2-yl-N'-pyridin-3-ylethane-1,2-diamine?
The InChIKey is XMGCDKQAZMKFLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-10(2)13-7-8-14(3)11-5-4-6-12-9-11/h4-6,9-10,13H,7-8H2,1-3H3.
What are the key properties of N'-methyl-N-propan-2-yl-N'-pyridin-3-ylethane-1,2-diamine?
N'-methyl-N-propan-2-yl-N'-pyridin-3-ylethane-1,2-diamine has a molecular weight of 193.29 g/mol, XLogP of 1.52, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methyl-N-propan-2-yl-N'-pyridin-3-ylethane-1,2-diamine is sourced from PubChem (CID 115206418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).