3-N-methyl-3-N-(pyridin-3-ylmethyl)propane-1,2,3-triamine

C10H18N4 — CID 115119904

IUPAC3-N-methyl-3-N-(pyridin-3-ylmethyl)propane-1,2,3-triamine
SMILESCN(Cc1cccnc1)CC(N)CN
InChIInChI=1S/C10H18N4/c1-14(8-10(12)5-11)7-9-3-2-4-13-6-9/h2-4,6,10H,5,7-8,11-12H2,1H3
InChIKeyNOYVSSGWFCIZDV-UHFFFAOYSA-N
MW194.28 g/mol
LogP-0.20
Rot. Bonds5

About 3-N-methyl-3-N-(pyridin-3-ylmethyl)propane-1,2,3-triamine

3-N-methyl-3-N-(pyridin-3-ylmethyl)propane-1,2,3-triamine (PubChem CID 115119904) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is 3-N-methyl-3-N-(pyridin-3-ylmethyl)propane-1,2,3-triamine.

Molecular Properties

Compound Name3-N-methyl-3-N-(pyridin-3-ylmethyl)propane-1,2,3-triamine
PubChem CID115119904
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC Name3-N-methyl-3-N-(pyridin-3-ylmethyl)propane-1,2,3-triamine
SMILESCN(Cc1cccnc1)CC(N)CN
InChIInChI=1S/C10H18N4/c1-14(8-10(12)5-11)7-9-3-2-4-13-6-9/h2-4,6,10H,5,7-8,11-12H2,1H3
InChIKeyNOYVSSGWFCIZDV-UHFFFAOYSA-N
XLogP-0.20
TPSA68.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 5-0.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N'-methyl-1-(4-methylphenyl)-N'-(pyridin-3-ylmethyl)ethane-1,2-diamine
CID 43563325
N'-methyl-N'-(pyridin-3-ylmethyl)butane-1,4-diamine
CID 43563175
2,2-diethoxy-N-methyl-N-(pyridin-3-ylmethyl)ethanamine
CID 55247242
[3-[[methyl(pyridin-3-ylmethyl)amino]methyl]phenyl]methanamine
CID 43248750
methyl (2S)-2-methyl-3-[methyl(pyridin-3-ylmethyl)amino]propanoate
CID 93035101
1-(2,4-difluorophenyl)-N'-methyl-N'-(pyridin-3-ylmethyl)ethane-1,2-diamine
CID 107519684
1-N-methyl-3-[(2E,4Z)-5-methylhepta-2,4,6-trien-3-yl]oxy-1-N-(pyridin-3-ylmethyl)propane-1,2-diamine
CID 145473011
N'-methyl-N'-(pyridin-3-ylmethyl)but-2-ene-1,4-diamine
CID 77110305
N,5-dimethyl-N-(pyridin-3-ylmethyl)hexan-1-amine
CID 59176505
2-(bromomethyl)-N,3,3-trimethyl-N-(pyridin-3-ylmethyl)butan-1-amine
CID 65015832
1-(3-methoxyphenyl)-N'-methyl-N'-(pyridin-3-ylmethyl)ethane-1,2-diamine
CID 43563312
2-N-propan-2-yl-2-N-(pyridin-3-ylmethyl)propane-1,2-diamine
CID 112709140

Frequently Asked Questions

What is the IUPAC name of 3-N-methyl-3-N-(pyridin-3-ylmethyl)propane-1,2,3-triamine?
The IUPAC name of 3-N-methyl-3-N-(pyridin-3-ylmethyl)propane-1,2,3-triamine (CID 115119904) is 3-N-methyl-3-N-(pyridin-3-ylmethyl)propane-1,2,3-triamine.
What is the SMILES notation for 3-N-methyl-3-N-(pyridin-3-ylmethyl)propane-1,2,3-triamine?
The canonical SMILES for 3-N-methyl-3-N-(pyridin-3-ylmethyl)propane-1,2,3-triamine is CN(Cc1cccnc1)CC(N)CN.
What is the InChIKey of 3-N-methyl-3-N-(pyridin-3-ylmethyl)propane-1,2,3-triamine?
The InChIKey is NOYVSSGWFCIZDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4/c1-14(8-10(12)5-11)7-9-3-2-4-13-6-9/h2-4,6,10H,5,7-8,11-12H2,1H3.
What are the key properties of 3-N-methyl-3-N-(pyridin-3-ylmethyl)propane-1,2,3-triamine?
3-N-methyl-3-N-(pyridin-3-ylmethyl)propane-1,2,3-triamine has a molecular weight of 194.28 g/mol, XLogP of -0.20, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-methyl-3-N-(pyridin-3-ylmethyl)propane-1,2,3-triamine is sourced from PubChem (CID 115119904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).