2-N-ethyl-1-N-methyl-1-N-(pyridin-2-ylmethyl)pentane-1,2-diamine

C14H25N3 — CID 62044465

IUPAC2-N-ethyl-1-N-methyl-1-N-(pyridin-2-ylmethyl)pentane-1,2-diamine
SMILESCCCC(CN(C)Cc1ccccn1)NCC
InChIInChI=1S/C14H25N3/c1-4-8-13(15-5-2)11-17(3)12-14-9-6-7-10-16-14/h6-7,9-10,13,15H,4-5,8,11-12H2,1-3H3
InChIKeySGAAWZGZHYAOGN-UHFFFAOYSA-N
MW235.38 g/mol
LogP2.29
Rot. Bonds8

About 2-N-ethyl-1-N-methyl-1-N-(pyridin-2-ylmethyl)pentane-1,2-diamine

2-N-ethyl-1-N-methyl-1-N-(pyridin-2-ylmethyl)pentane-1,2-diamine (PubChem CID 62044465) has the molecular formula C14H25N3 and a molecular weight of 235.38 g/mol. Its IUPAC name is 2-N-ethyl-1-N-methyl-1-N-(pyridin-2-ylmethyl)pentane-1,2-diamine.

Molecular Properties

Compound Name2-N-ethyl-1-N-methyl-1-N-(pyridin-2-ylmethyl)pentane-1,2-diamine
PubChem CID62044465
Molecular FormulaC14H25N3
Molecular Weight235.38 g/mol
Exact Mass235.20
IUPAC Name2-N-ethyl-1-N-methyl-1-N-(pyridin-2-ylmethyl)pentane-1,2-diamine
SMILESCCCC(CN(C)Cc1ccccn1)NCC
InChIInChI=1S/C14H25N3/c1-4-8-13(15-5-2)11-17(3)12-14-9-6-7-10-16-14/h6-7,9-10,13,15H,4-5,8,11-12H2,1-3H3
InChIKeySGAAWZGZHYAOGN-UHFFFAOYSA-N
XLogP2.29
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 ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-N-ethyl-1-N,4,4-trimethyl-1-N-(pyridin-2-ylmethyl)pentane-1,3-diamine
CID 62623524
N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine;hydrochloride
CID 174963433
ethane;N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine
CID 145471467
N',N'-dimethyl-N-(1-pyridin-2-ylpentan-2-yl)ethane-1,2-diamine
CID 137425939
1-(methylamino)-3-[methyl(pyridin-2-ylmethyl)amino]propan-2-ol
CID 43564841
2-N-ethyl-4-N-methyl-4-N-(pyridin-2-ylmethyl)pentane-2,4-diamine
CID 64706979
N-ethyl-1-pyridin-2-yloctan-3-amine
CID 105129891
2-[[methyl(pyridin-2-ylmethyl)amino]methyl]butanenitrile
CID 115253964
1-chloro-3-[methyl(pyridin-2-ylmethyl)amino]propan-2-ol
CID 112561273
N-butan-2-yl-N'-methyl-N'-(pyridin-2-ylmethyl)ethane-1,2-diamine
CID 60853394
1-pyridin-2-ylpentan-2-ylhydrazine
CID 105199777
N-ethyl-6-[[methyl(pyridin-2-ylmethyl)amino]methyl]pyridin-2-amine
CID 79243794

Frequently Asked Questions

What is the IUPAC name of 2-N-ethyl-1-N-methyl-1-N-(pyridin-2-ylmethyl)pentane-1,2-diamine?
The IUPAC name of 2-N-ethyl-1-N-methyl-1-N-(pyridin-2-ylmethyl)pentane-1,2-diamine (CID 62044465) is 2-N-ethyl-1-N-methyl-1-N-(pyridin-2-ylmethyl)pentane-1,2-diamine.
What is the SMILES notation for 2-N-ethyl-1-N-methyl-1-N-(pyridin-2-ylmethyl)pentane-1,2-diamine?
The canonical SMILES for 2-N-ethyl-1-N-methyl-1-N-(pyridin-2-ylmethyl)pentane-1,2-diamine is CCCC(CN(C)Cc1ccccn1)NCC.
What is the InChIKey of 2-N-ethyl-1-N-methyl-1-N-(pyridin-2-ylmethyl)pentane-1,2-diamine?
The InChIKey is SGAAWZGZHYAOGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-4-8-13(15-5-2)11-17(3)12-14-9-6-7-10-16-14/h6-7,9-10,13,15H,4-5,8,11-12H2,1-3H3.
What are the key properties of 2-N-ethyl-1-N-methyl-1-N-(pyridin-2-ylmethyl)pentane-1,2-diamine?
2-N-ethyl-1-N-methyl-1-N-(pyridin-2-ylmethyl)pentane-1,2-diamine has a molecular weight of 235.38 g/mol, XLogP of 2.29, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-ethyl-1-N-methyl-1-N-(pyridin-2-ylmethyl)pentane-1,2-diamine is sourced from PubChem (CID 62044465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).