N',N'-dimethyl-N-(1-pyridin-2-ylpentan-2-yl)ethane-1,2-diamine

C14H25N3 — CID 137425939

IUPACN',N'-dimethyl-N-(1-pyridin-2-ylpentan-2-yl)ethane-1,2-diamine
SMILESCCCC(Cc1ccccn1)NCCN(C)C
InChIInChI=1S/C14H25N3/c1-4-7-13(16-10-11-17(2)3)12-14-8-5-6-9-15-14/h5-6,8-9,13,16H,4,7,10-12H2,1-3H3
InChIKeyHCCOYFIRGIEBPL-UHFFFAOYSA-N
MW235.38 g/mol
LogP1.94
Rot. Bonds8

About N',N'-dimethyl-N-(1-pyridin-2-ylpentan-2-yl)ethane-1,2-diamine

N',N'-dimethyl-N-(1-pyridin-2-ylpentan-2-yl)ethane-1,2-diamine (PubChem CID 137425939) has the molecular formula C14H25N3 and a molecular weight of 235.38 g/mol. Its IUPAC name is N',N'-dimethyl-N-(1-pyridin-2-ylpentan-2-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN',N'-dimethyl-N-(1-pyridin-2-ylpentan-2-yl)ethane-1,2-diamine
PubChem CID137425939
Molecular FormulaC14H25N3
Molecular Weight235.38 g/mol
Exact Mass235.20
IUPAC NameN',N'-dimethyl-N-(1-pyridin-2-ylpentan-2-yl)ethane-1,2-diamine
SMILESCCCC(Cc1ccccn1)NCCN(C)C
InChIInChI=1S/C14H25N3/c1-4-7-13(16-10-11-17(2)3)12-14-8-5-6-9-15-14/h5-6,8-9,13,16H,4,7,10-12H2,1-3H3
InChIKeyHCCOYFIRGIEBPL-UHFFFAOYSA-N
XLogP1.94
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 ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-pyridin-2-ylpentan-2-ylhydrazine
CID 105199777
4-methylsulfanyl-N-propyl-1-pyridin-2-ylbutan-2-amine
CID 105157999
4-methyl-N-propyl-1-pyridin-2-ylhexan-2-amine
CID 62600384
2-N-ethyl-1-N-methyl-1-N-(pyridin-2-ylmethyl)pentane-1,2-diamine
CID 62044465
1-(2-methylphenyl)-N-propyl-3-pyridin-2-ylpropan-2-amine
CID 60818337
N-propyl-1-quinoxalin-2-ylpentan-2-amine
CID 63198228
1-(oxan-4-yl)-N-propyl-3-pyridin-2-ylpropan-2-amine
CID 62600579
3-methyl-N-propyl-1-pyridin-2-ylbutan-2-amine
CID 60820074
1-(2-fluorophenyl)-N-propyl-4-pyridin-2-ylbutan-2-amine
CID 105090087
N-propyl-1-pyridin-2-yl-3-(1,3-thiazol-5-yl)propan-2-amine
CID 112642797
N-propyl-1-quinolin-2-ylpentan-2-amine
CID 63198598
N-propyl-1-(1-propylimidazol-2-yl)-3-pyridin-2-ylpropan-2-amine
CID 79752625

Frequently Asked Questions

What is the IUPAC name of N',N'-dimethyl-N-(1-pyridin-2-ylpentan-2-yl)ethane-1,2-diamine?
The IUPAC name of N',N'-dimethyl-N-(1-pyridin-2-ylpentan-2-yl)ethane-1,2-diamine (CID 137425939) is N',N'-dimethyl-N-(1-pyridin-2-ylpentan-2-yl)ethane-1,2-diamine.
What is the SMILES notation for N',N'-dimethyl-N-(1-pyridin-2-ylpentan-2-yl)ethane-1,2-diamine?
The canonical SMILES for N',N'-dimethyl-N-(1-pyridin-2-ylpentan-2-yl)ethane-1,2-diamine is CCCC(Cc1ccccn1)NCCN(C)C.
What is the InChIKey of N',N'-dimethyl-N-(1-pyridin-2-ylpentan-2-yl)ethane-1,2-diamine?
The InChIKey is HCCOYFIRGIEBPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-4-7-13(16-10-11-17(2)3)12-14-8-5-6-9-15-14/h5-6,8-9,13,16H,4,7,10-12H2,1-3H3.
What are the key properties of N',N'-dimethyl-N-(1-pyridin-2-ylpentan-2-yl)ethane-1,2-diamine?
N',N'-dimethyl-N-(1-pyridin-2-ylpentan-2-yl)ethane-1,2-diamine has a molecular weight of 235.38 g/mol, XLogP of 1.94, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-dimethyl-N-(1-pyridin-2-ylpentan-2-yl)ethane-1,2-diamine is sourced from PubChem (CID 137425939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).