N'-cyclohexyl-N'-(pyridin-3-ylmethyl)ethane-1,2-diamine

C14H23N3 — CID 55242009

IUPACN'-cyclohexyl-N'-(pyridin-3-ylmethyl)ethane-1,2-diamine
SMILESNCCN(Cc1cccnc1)C1CCCCC1
InChIInChI=1S/C14H23N3/c15-8-10-17(14-6-2-1-3-7-14)12-13-5-4-9-16-11-13/h4-5,9,11,14H,1-3,6-8,10,12,15H2
InChIKeyMAMVSTFYOBCDGA-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.17
Rot. Bonds5

About N'-cyclohexyl-N'-(pyridin-3-ylmethyl)ethane-1,2-diamine

N'-cyclohexyl-N'-(pyridin-3-ylmethyl)ethane-1,2-diamine (PubChem CID 55242009) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is N'-cyclohexyl-N'-(pyridin-3-ylmethyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-cyclohexyl-N'-(pyridin-3-ylmethyl)ethane-1,2-diamine
PubChem CID55242009
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC NameN'-cyclohexyl-N'-(pyridin-3-ylmethyl)ethane-1,2-diamine
SMILESNCCN(Cc1cccnc1)C1CCCCC1
InChIInChI=1S/C14H23N3/c15-8-10-17(14-6-2-1-3-7-14)12-13-5-4-9-16-11-13/h4-5,9,11,14H,1-3,6-8,10,12,15H2
InChIKeyMAMVSTFYOBCDGA-UHFFFAOYSA-N
XLogP2.17
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-bromoethyl)-N-(pyridin-3-ylmethyl)cyclopentanamine
CID 80672034
2-[cycloheptyl(pyridin-3-ylmethyl)amino]acetic acid
CID 46993000
N'-cyclohexyl-N'-[(5-methyl-3-pyridinyl)methyl]ethane-1,2-diamine
CID 102879102
4-[cyclopropyl(pyridin-3-ylmethyl)amino]butan-1-ol
CID 56795318
4-N-propyl-4-N-(pyridin-3-ylmethyl)cyclohexane-1,4-diamine
CID 79112211
N'-[(4-bromophenyl)methyl]-N'-cyclohexylethane-1,2-diamine
CID 39449548
N'-[(3-chlorophenyl)methyl]-N'-cyclopentylethane-1,2-diamine
CID 39356192
N'-cycloheptyl-N'-[(3-ethoxyphenyl)methyl]ethane-1,2-diamine
CID 39396373
3-[(3-aminocyclohexyl)-(pyridin-3-ylmethyl)amino]propanenitrile
CID 79468158
N'-cyclohexyl-N'-[[4-(trifluoromethyl)phenyl]methyl]ethane-1,2-diamine
CID 63761871
4-N-ethyl-4-N-(pyridin-3-ylmethyl)cyclohexane-1,4-diamine
CID 79116173
N-propyl-N-(pyridin-3-ylmethyl)piperidin-3-amine
CID 55244721

Frequently Asked Questions

What is the IUPAC name of N'-cyclohexyl-N'-(pyridin-3-ylmethyl)ethane-1,2-diamine?
The IUPAC name of N'-cyclohexyl-N'-(pyridin-3-ylmethyl)ethane-1,2-diamine (CID 55242009) is N'-cyclohexyl-N'-(pyridin-3-ylmethyl)ethane-1,2-diamine.
What is the SMILES notation for N'-cyclohexyl-N'-(pyridin-3-ylmethyl)ethane-1,2-diamine?
The canonical SMILES for N'-cyclohexyl-N'-(pyridin-3-ylmethyl)ethane-1,2-diamine is NCCN(Cc1cccnc1)C1CCCCC1.
What is the InChIKey of N'-cyclohexyl-N'-(pyridin-3-ylmethyl)ethane-1,2-diamine?
The InChIKey is MAMVSTFYOBCDGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c15-8-10-17(14-6-2-1-3-7-14)12-13-5-4-9-16-11-13/h4-5,9,11,14H,1-3,6-8,10,12,15H2.
What are the key properties of N'-cyclohexyl-N'-(pyridin-3-ylmethyl)ethane-1,2-diamine?
N'-cyclohexyl-N'-(pyridin-3-ylmethyl)ethane-1,2-diamine has a molecular weight of 233.36 g/mol, XLogP of 2.17, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclohexyl-N'-(pyridin-3-ylmethyl)ethane-1,2-diamine is sourced from PubChem (CID 55242009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).