N-(4-ethyl-2-pyridinyl)-N',N'-dimethylethane-1,2-diamine;molecular hydrogen

C11H21N3 — CID 178169396

IUPACN-(4-ethyl-2-pyridinyl)-N',N'-dimethylethane-1,2-diamine;molecular hydrogen
SMILESCCc1ccnc(NCCN(C)C)c1.[H][H]
InChIInChI=1S/C11H19N3.H2/c1-4-10-5-6-12-11(9-10)13-7-8-14(2)3;/h5-6,9H,4,7-8H2,1-3H3,(H,12,13);1H
InChIKeyCDDFHWODOTVMBO-UHFFFAOYSA-N
MW195.31 g/mol
LogP1.86
Rot. Bonds5

About N-(4-ethyl-2-pyridinyl)-N',N'-dimethylethane-1,2-diamine;molecular hydrogen

N-(4-ethyl-2-pyridinyl)-N',N'-dimethylethane-1,2-diamine;molecular hydrogen (PubChem CID 178169396) has the molecular formula C11H21N3 and a molecular weight of 195.31 g/mol. Its IUPAC name is N-(4-ethyl-2-pyridinyl)-N',N'-dimethylethane-1,2-diamine;molecular hydrogen.

Molecular Properties

Compound NameN-(4-ethyl-2-pyridinyl)-N',N'-dimethylethane-1,2-diamine;molecular hydrogen
PubChem CID178169396
Molecular FormulaC11H21N3
Molecular Weight195.31 g/mol
Exact Mass195.17
IUPAC NameN-(4-ethyl-2-pyridinyl)-N',N'-dimethylethane-1,2-diamine;molecular hydrogen
SMILESCCc1ccnc(NCCN(C)C)c1.[H][H]
InChIInChI=1S/C11H19N3.H2/c1-4-10-5-6-12-11(9-10)13-7-8-14(2)3;/h5-6,9H,4,7-8H2,1-3H3,(H,12,13);1H
InChIKeyCDDFHWODOTVMBO-UHFFFAOYSA-N
XLogP1.86
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(dimethylamino)ethylamino]pyridine-4-carbonitrile
CID 24703925
6-N-[2-(dimethylamino)ethyl]-4-N-(pyridin-4-ylmethyl)pyrimidine-4,6-diamine
CID 112857392
N-(6-ethylpyrimidin-4-yl)-N',N'-dimethylethane-1,2-diamine
CID 61234929
4-[[ethyl(methyl)amino]methyl]-N-propylpyridin-2-amine
CID 62472407
N',N'-dimethyl-N-(6-methylpyrimidin-4-yl)ethane-1,2-diamine
CID 61225693
2-[2-(dimethylamino)ethylamino]-N-(pyridin-4-ylmethyl)pyridine-4-carboxamide
CID 109167796
4-(diethylaminomethyl)-N-propylpyridin-2-amine
CID 62472000
4-[[methyl(3-methylbutyl)amino]methyl]-N-propylpyridin-2-amine
CID 62465932
2-[2-(dimethylamino)ethylamino]-N-[3-(dimethylamino)propyl]pyridine-4-carboxamide
CID 109167778
N',N'-dimethyl-N-(5-methyl-2-pyridinyl)ethane-1,2-diamine;molecular hydrogen
CID 145001272
4-[[(4-fluorophenyl)methyl-methylamino]methyl]-N-propylpyridin-2-amine
CID 62464531
4-[[ethyl(2-methylpropyl)amino]methyl]-N-propylpyridin-2-amine
CID 62470960

Frequently Asked Questions

What is the IUPAC name of N-(4-ethyl-2-pyridinyl)-N',N'-dimethylethane-1,2-diamine;molecular hydrogen?
The IUPAC name of N-(4-ethyl-2-pyridinyl)-N',N'-dimethylethane-1,2-diamine;molecular hydrogen (CID 178169396) is N-(4-ethyl-2-pyridinyl)-N',N'-dimethylethane-1,2-diamine;molecular hydrogen.
What is the SMILES notation for N-(4-ethyl-2-pyridinyl)-N',N'-dimethylethane-1,2-diamine;molecular hydrogen?
The canonical SMILES for N-(4-ethyl-2-pyridinyl)-N',N'-dimethylethane-1,2-diamine;molecular hydrogen is CCc1ccnc(NCCN(C)C)c1.[H][H].
What is the InChIKey of N-(4-ethyl-2-pyridinyl)-N',N'-dimethylethane-1,2-diamine;molecular hydrogen?
The InChIKey is CDDFHWODOTVMBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3.H2/c1-4-10-5-6-12-11(9-10)13-7-8-14(2)3;/h5-6,9H,4,7-8H2,1-3H3,(H,12,13);1H.
What are the key properties of N-(4-ethyl-2-pyridinyl)-N',N'-dimethylethane-1,2-diamine;molecular hydrogen?
N-(4-ethyl-2-pyridinyl)-N',N'-dimethylethane-1,2-diamine;molecular hydrogen has a molecular weight of 195.31 g/mol, XLogP of 1.86, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethyl-2-pyridinyl)-N',N'-dimethylethane-1,2-diamine;molecular hydrogen is sourced from PubChem (CID 178169396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).