N-ethyl-N',2-dimethyl-N'-(2-pyridin-2-ylethyl)propane-1,3-diamine

C14H25N3 — CID 62418035

IUPACN-ethyl-N',2-dimethyl-N'-(2-pyridin-2-ylethyl)propane-1,3-diamine
SMILESCCNCC(C)CN(C)CCc1ccccn1
InChIInChI=1S/C14H25N3/c1-4-15-11-13(2)12-17(3)10-8-14-7-5-6-9-16-14/h5-7,9,13,15H,4,8,10-12H2,1-3H3
InChIKeyURZMNMJNTUEYJJ-UHFFFAOYSA-N
MW235.38 g/mol
LogP1.80
Rot. Bonds8

About N-ethyl-N',2-dimethyl-N'-(2-pyridin-2-ylethyl)propane-1,3-diamine

N-ethyl-N',2-dimethyl-N'-(2-pyridin-2-ylethyl)propane-1,3-diamine (PubChem CID 62418035) has the molecular formula C14H25N3 and a molecular weight of 235.38 g/mol. Its IUPAC name is N-ethyl-N',2-dimethyl-N'-(2-pyridin-2-ylethyl)propane-1,3-diamine.

Molecular Properties

Compound NameN-ethyl-N',2-dimethyl-N'-(2-pyridin-2-ylethyl)propane-1,3-diamine
PubChem CID62418035
Molecular FormulaC14H25N3
Molecular Weight235.38 g/mol
Exact Mass235.20
IUPAC NameN-ethyl-N',2-dimethyl-N'-(2-pyridin-2-ylethyl)propane-1,3-diamine
SMILESCCNCC(C)CN(C)CCc1ccccn1
InChIInChI=1S/C14H25N3/c1-4-15-11-13(2)12-17(3)10-8-14-7-5-6-9-16-14/h5-7,9,13,15H,4,8,10-12H2,1-3H3
InChIKeyURZMNMJNTUEYJJ-UHFFFAOYSA-N
XLogP1.80
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.38
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-(2-pyridin-2-ylethyl)propan-1-amine
CID 21307320
1-[methyl(2-pyridin-2-ylethyl)amino]pentan-2-ol
CID 62042147
1-(methylamino)-3-[methyl(2-pyridin-2-ylethyl)amino]propan-2-ol
CID 43187938
2-N-methyl-1-N-(2-methylpropyl)-2-N-(2-pyridin-2-ylethyl)propane-1,2-diamine
CID 62417470
2-[[methyl(2-pyridin-2-ylethyl)amino]methyl]butan-1-ol
CID 115251118
2-methyl-3-[methyl(2-pyridin-2-ylethyl)amino]propanoic acid
CID 43538751
2-N-methyl-1-N-(2-methylpropyl)-2-N-(2-pyridin-2-ylethyl)pentane-1,2-diamine
CID 83042410
2-ethyl-N',2-dimethyl-N-(2-methylpropyl)-N'-(2-pyridin-2-ylethyl)propane-1,3-diamine
CID 62261959
2-benzylsulfanyl-N-methyl-N-(2-pyridin-2-ylethyl)propan-1-amine
CID 71426765
ethane;N-methyl-N-(2-pyridin-2-ylethyl)propan-2-amine
CID 142585406
1-(1-methoxypropan-2-yloxy)-3-[methyl(2-pyridin-2-ylethyl)amino]propan-2-ol
CID 106991705
2-N-methyl-2-N-(2-pyridin-2-ylethyl)-1-N-(2,2,2-trifluoroethyl)propane-1,2-diamine
CID 62557484

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N',2-dimethyl-N'-(2-pyridin-2-ylethyl)propane-1,3-diamine?
The IUPAC name of N-ethyl-N',2-dimethyl-N'-(2-pyridin-2-ylethyl)propane-1,3-diamine (CID 62418035) is N-ethyl-N',2-dimethyl-N'-(2-pyridin-2-ylethyl)propane-1,3-diamine.
What is the SMILES notation for N-ethyl-N',2-dimethyl-N'-(2-pyridin-2-ylethyl)propane-1,3-diamine?
The canonical SMILES for N-ethyl-N',2-dimethyl-N'-(2-pyridin-2-ylethyl)propane-1,3-diamine is CCNCC(C)CN(C)CCc1ccccn1.
What is the InChIKey of N-ethyl-N',2-dimethyl-N'-(2-pyridin-2-ylethyl)propane-1,3-diamine?
The InChIKey is URZMNMJNTUEYJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-4-15-11-13(2)12-17(3)10-8-14-7-5-6-9-16-14/h5-7,9,13,15H,4,8,10-12H2,1-3H3.
What are the key properties of N-ethyl-N',2-dimethyl-N'-(2-pyridin-2-ylethyl)propane-1,3-diamine?
N-ethyl-N',2-dimethyl-N'-(2-pyridin-2-ylethyl)propane-1,3-diamine has a molecular weight of 235.38 g/mol, XLogP of 1.80, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N',2-dimethyl-N'-(2-pyridin-2-ylethyl)propane-1,3-diamine is sourced from PubChem (CID 62418035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).