N'-propyl-N'-(2-pyridin-3-ylethyl)ethane-1,2-diamine

C12H21N3 — CID 63265157

IUPACN'-propyl-N'-(2-pyridin-3-ylethyl)ethane-1,2-diamine
SMILESCCCN(CCN)CCc1cccnc1
InChIInChI=1S/C12H21N3/c1-2-8-15(10-6-13)9-5-12-4-3-7-14-11-12/h3-4,7,11H,2,5-6,8-10,13H2,1H3
InChIKeyGNCROMGKKNJYRS-UHFFFAOYSA-N
MW207.32 g/mol
LogP1.29
Rot. Bonds7

About N'-propyl-N'-(2-pyridin-3-ylethyl)ethane-1,2-diamine

N'-propyl-N'-(2-pyridin-3-ylethyl)ethane-1,2-diamine (PubChem CID 63265157) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is N'-propyl-N'-(2-pyridin-3-ylethyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-propyl-N'-(2-pyridin-3-ylethyl)ethane-1,2-diamine
PubChem CID63265157
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC NameN'-propyl-N'-(2-pyridin-3-ylethyl)ethane-1,2-diamine
SMILESCCCN(CCN)CCc1cccnc1
InChIInChI=1S/C12H21N3/c1-2-8-15(10-6-13)9-5-12-4-3-7-14-11-12/h3-4,7,11H,2,5-6,8-10,13H2,1H3
InChIKeyGNCROMGKKNJYRS-UHFFFAOYSA-N
XLogP1.29
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N'-propyl-N'-(pyridin-3-ylmethyl)ethane-1,2-diamine
CID 61348602
2-[propyl(2-pyridin-3-ylethyl)amino]acetonitrile
CID 63264561
N'-ethyl-N'-(2-pyridin-3-ylethyl)propane-1,3-diamine
CID 63264719
2-[[propyl(2-pyridin-3-ylethyl)amino]methyl]aniline
CID 63262604
2-methyl-N-propyl-N-(2-pyridin-3-ylethyl)propan-2-amine
CID 59134912
2-N-methyl-2-N-(2-pyridin-3-ylethyl)propane-1,2-diamine
CID 112708855
3-[ethyl(2-pyridin-3-ylethyl)amino]propanethioamide
CID 63264785
N,N-diethyl-3-pyridin-3-ylpropan-1-amine
CID 121009449
N-propyl-N-(2-pyridin-3-ylethyl)propanamide
CID 10262913
methyl(2-pyridin-3-ylethyl)cyanamide
CID 117043571
2-ethyl-N'-methyl-N'-(2-pyridin-3-ylethyl)propane-1,3-diamine
CID 115251756
N-propyl-N-(2-pyridin-3-ylethyl)-8-azabicyclo[3.2.1]octan-3-amine
CID 63262796

Frequently Asked Questions

What is the IUPAC name of N'-propyl-N'-(2-pyridin-3-ylethyl)ethane-1,2-diamine?
The IUPAC name of N'-propyl-N'-(2-pyridin-3-ylethyl)ethane-1,2-diamine (CID 63265157) is N'-propyl-N'-(2-pyridin-3-ylethyl)ethane-1,2-diamine.
What is the SMILES notation for N'-propyl-N'-(2-pyridin-3-ylethyl)ethane-1,2-diamine?
The canonical SMILES for N'-propyl-N'-(2-pyridin-3-ylethyl)ethane-1,2-diamine is CCCN(CCN)CCc1cccnc1.
What is the InChIKey of N'-propyl-N'-(2-pyridin-3-ylethyl)ethane-1,2-diamine?
The InChIKey is GNCROMGKKNJYRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3/c1-2-8-15(10-6-13)9-5-12-4-3-7-14-11-12/h3-4,7,11H,2,5-6,8-10,13H2,1H3.
What are the key properties of N'-propyl-N'-(2-pyridin-3-ylethyl)ethane-1,2-diamine?
N'-propyl-N'-(2-pyridin-3-ylethyl)ethane-1,2-diamine has a molecular weight of 207.32 g/mol, XLogP of 1.29, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-propyl-N'-(2-pyridin-3-ylethyl)ethane-1,2-diamine is sourced from PubChem (CID 63265157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).