N-(2-bicyclo[2.2.1]heptanyl)-6-(2-methylimidazol-1-yl)pyridin-3-amine

C16H20N4 — CID 61309933

IUPACN-(2-bicyclo[2.2.1]heptanyl)-6-(2-methylimidazol-1-yl)pyridin-3-amine
SMILESCc1nccn1-c1ccc(NC2CC3CCC2C3)cn1
InChIInChI=1S/C16H20N4/c1-11-17-6-7-20(11)16-5-4-14(10-18-16)19-15-9-12-2-3-13(15)8-12/h4-7,10,12-13,15,19H,2-3,8-9H2,1H3
InChIKeyMNNKZZUUVCZVOE-UHFFFAOYSA-N
MW268.36 g/mol
LogP3.18
Rot. Bonds3

About N-(2-bicyclo[2.2.1]heptanyl)-6-(2-methylimidazol-1-yl)pyridin-3-amine

N-(2-bicyclo[2.2.1]heptanyl)-6-(2-methylimidazol-1-yl)pyridin-3-amine (PubChem CID 61309933) has the molecular formula C16H20N4 and a molecular weight of 268.36 g/mol. Its IUPAC name is N-(2-bicyclo[2.2.1]heptanyl)-6-(2-methylimidazol-1-yl)pyridin-3-amine.

Molecular Properties

Compound NameN-(2-bicyclo[2.2.1]heptanyl)-6-(2-methylimidazol-1-yl)pyridin-3-amine
PubChem CID61309933
Molecular FormulaC16H20N4
Molecular Weight268.36 g/mol
Exact Mass268.17
IUPAC NameN-(2-bicyclo[2.2.1]heptanyl)-6-(2-methylimidazol-1-yl)pyridin-3-amine
SMILESCc1nccn1-c1ccc(NC2CC3CCC2C3)cn1
InChIInChI=1S/C16H20N4/c1-11-17-6-7-20(11)16-5-4-14(10-18-16)19-15-9-12-2-3-13(15)8-12/h4-7,10,12-13,15,19H,2-3,8-9H2,1H3
InChIKeyMNNKZZUUVCZVOE-UHFFFAOYSA-N
XLogP3.18
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methylcyclopentyl)-6-(2-methylimidazol-1-yl)pyridin-3-amine
CID 65044202
N-(2,5-dimethylcyclohexyl)-6-(2-methylimidazol-1-yl)pyridin-3-amine
CID 64761065
6-(2-methylimidazol-1-yl)-N-(2-methylthian-3-yl)pyridin-3-amine
CID 79956764
N-(2-bicyclo[2.2.1]heptanyl)-6-piperidin-1-ylpyridin-3-amine
CID 61310129
6-(2-methylimidazol-1-yl)-N-(2-methyloxolan-3-yl)pyridin-3-amine
CID 82726882
4-N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]cyclohexane-1,4-diamine
CID 79731624
N-(3-methoxycyclobutyl)-6-(2-methylimidazol-1-yl)pyridin-3-amine
CID 106821421
N-(2-bicyclo[2.2.1]heptanyl)-6-(1,2,4-triazol-1-yl)pyridin-3-amine
CID 61310336
6-(2-methylimidazol-1-yl)-N-(oxepan-4-yl)pyridin-3-amine
CID 65081498
N-(3,3-dimethylcyclopentyl)-6-(2-methylimidazol-1-yl)pyridin-3-amine
CID 80706120
N-ethyl-6-(2-methylimidazol-1-yl)pyridin-3-amine
CID 43748706
(1S,2R,4S)-N-(4-methylphenyl)bicyclo[2.2.1]heptan-2-amine
CID 124526666

Frequently Asked Questions

What is the IUPAC name of N-(2-bicyclo[2.2.1]heptanyl)-6-(2-methylimidazol-1-yl)pyridin-3-amine?
The IUPAC name of N-(2-bicyclo[2.2.1]heptanyl)-6-(2-methylimidazol-1-yl)pyridin-3-amine (CID 61309933) is N-(2-bicyclo[2.2.1]heptanyl)-6-(2-methylimidazol-1-yl)pyridin-3-amine.
What is the SMILES notation for N-(2-bicyclo[2.2.1]heptanyl)-6-(2-methylimidazol-1-yl)pyridin-3-amine?
The canonical SMILES for N-(2-bicyclo[2.2.1]heptanyl)-6-(2-methylimidazol-1-yl)pyridin-3-amine is Cc1nccn1-c1ccc(NC2CC3CCC2C3)cn1.
What is the InChIKey of N-(2-bicyclo[2.2.1]heptanyl)-6-(2-methylimidazol-1-yl)pyridin-3-amine?
The InChIKey is MNNKZZUUVCZVOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4/c1-11-17-6-7-20(11)16-5-4-14(10-18-16)19-15-9-12-2-3-13(15)8-12/h4-7,10,12-13,15,19H,2-3,8-9H2,1H3.
What are the key properties of N-(2-bicyclo[2.2.1]heptanyl)-6-(2-methylimidazol-1-yl)pyridin-3-amine?
N-(2-bicyclo[2.2.1]heptanyl)-6-(2-methylimidazol-1-yl)pyridin-3-amine has a molecular weight of 268.36 g/mol, XLogP of 3.18, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bicyclo[2.2.1]heptanyl)-6-(2-methylimidazol-1-yl)pyridin-3-amine is sourced from PubChem (CID 61309933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).