N-(2-bicyclo[2.2.1]heptanyl)-3-propoxypyridin-2-amine

C15H22N2O — CID 113370946

IUPACN-(2-bicyclo[2.2.1]heptanyl)-3-propoxypyridin-2-amine
SMILESCCCOc1cccnc1NC1CC2CCC1C2
InChIInChI=1S/C15H22N2O/c1-2-8-18-14-4-3-7-16-15(14)17-13-10-11-5-6-12(13)9-11/h3-4,7,11-13H,2,5-6,8-10H2,1H3,(H,16,17)
InChIKeyKQGOWEIKMVNCAJ-UHFFFAOYSA-N
MW246.35 g/mol
LogP3.47
Rot. Bonds5

About N-(2-bicyclo[2.2.1]heptanyl)-3-propoxypyridin-2-amine

N-(2-bicyclo[2.2.1]heptanyl)-3-propoxypyridin-2-amine (PubChem CID 113370946) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is N-(2-bicyclo[2.2.1]heptanyl)-3-propoxypyridin-2-amine.

Molecular Properties

Compound NameN-(2-bicyclo[2.2.1]heptanyl)-3-propoxypyridin-2-amine
PubChem CID113370946
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC NameN-(2-bicyclo[2.2.1]heptanyl)-3-propoxypyridin-2-amine
SMILESCCCOc1cccnc1NC1CC2CCC1C2
InChIInChI=1S/C15H22N2O/c1-2-8-18-14-4-3-7-16-15(14)17-13-10-11-5-6-12(13)9-11/h3-4,7,11-13H,2,5-6,8-10H2,1H3,(H,16,17)
InChIKeyKQGOWEIKMVNCAJ-UHFFFAOYSA-N
XLogP3.47
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-propoxyphenyl)bicyclo[2.2.1]heptan-2-amine
CID 63426599
N-(4-propoxyphenyl)bicyclo[2.2.1]heptan-2-amine
CID 55194098
N-[(4S)-4-methoxypyrrolidin-3-yl]-3-propoxypyridin-2-amine
CID 113371049
N-(3-propoxy-2-pyridinyl)-3-azabicyclo[3.1.0]hexan-6-amine
CID 113371050
3-N-(2-bicyclo[2.2.1]heptanyl)pyridine-2,3-diamine
CID 104540446
5-[(3-propoxy-2-pyridinyl)amino]piperidin-2-one
CID 113370927
1-methyl-3-[(3-propoxy-2-pyridinyl)amino]pyrrolidin-2-one
CID 106258259
3-N-(2-bicyclo[2.2.1]heptanyl)-2-N,2-N-dimethylpyridine-2,3-diamine
CID 61308040
[2-bicyclo[2.2.1]heptanyl-(2-propoxyphenyl)methyl]hydrazine
CID 105266649
N-(2-bicyclo[2.2.1]heptanyl)-2-propan-2-yloxypyridin-3-amine
CID 63454222
2-(2-bicyclo[2.2.1]heptanyl)-N-methyl-1-(2-propoxyphenyl)ethanamine
CID 105035765
N-[(2-aminocyclopentyl)methyl]-3-propoxypyridin-2-amine
CID 113371376

Frequently Asked Questions

What is the IUPAC name of N-(2-bicyclo[2.2.1]heptanyl)-3-propoxypyridin-2-amine?
The IUPAC name of N-(2-bicyclo[2.2.1]heptanyl)-3-propoxypyridin-2-amine (CID 113370946) is N-(2-bicyclo[2.2.1]heptanyl)-3-propoxypyridin-2-amine.
What is the SMILES notation for N-(2-bicyclo[2.2.1]heptanyl)-3-propoxypyridin-2-amine?
The canonical SMILES for N-(2-bicyclo[2.2.1]heptanyl)-3-propoxypyridin-2-amine is CCCOc1cccnc1NC1CC2CCC1C2.
What is the InChIKey of N-(2-bicyclo[2.2.1]heptanyl)-3-propoxypyridin-2-amine?
The InChIKey is KQGOWEIKMVNCAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-2-8-18-14-4-3-7-16-15(14)17-13-10-11-5-6-12(13)9-11/h3-4,7,11-13H,2,5-6,8-10H2,1H3,(H,16,17).
What are the key properties of N-(2-bicyclo[2.2.1]heptanyl)-3-propoxypyridin-2-amine?
N-(2-bicyclo[2.2.1]heptanyl)-3-propoxypyridin-2-amine has a molecular weight of 246.35 g/mol, XLogP of 3.47, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bicyclo[2.2.1]heptanyl)-3-propoxypyridin-2-amine is sourced from PubChem (CID 113370946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).