N-[[3-(aminomethyl)oxetan-3-yl]methyl]pyridin-2-amine

C10H15N3O — CID 115249253

IUPACN-[[3-(aminomethyl)oxetan-3-yl]methyl]pyridin-2-amine
SMILESNCC1(CNc2ccccn2)COC1
InChIInChI=1S/C10H15N3O/c11-5-10(7-14-8-10)6-13-9-3-1-2-4-12-9/h1-4H,5-8,11H2,(H,12,13)
InChIKeyZQISAVAVUSSMKS-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.47
Rot. Bonds4

About N-[[3-(aminomethyl)oxetan-3-yl]methyl]pyridin-2-amine

N-[[3-(aminomethyl)oxetan-3-yl]methyl]pyridin-2-amine (PubChem CID 115249253) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is N-[[3-(aminomethyl)oxetan-3-yl]methyl]pyridin-2-amine.

Molecular Properties

Compound NameN-[[3-(aminomethyl)oxetan-3-yl]methyl]pyridin-2-amine
PubChem CID115249253
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC NameN-[[3-(aminomethyl)oxetan-3-yl]methyl]pyridin-2-amine
SMILESNCC1(CNc2ccccn2)COC1
InChIInChI=1S/C10H15N3O/c11-5-10(7-14-8-10)6-13-9-3-1-2-4-12-9/h1-4H,5-8,11H2,(H,12,13)
InChIKeyZQISAVAVUSSMKS-UHFFFAOYSA-N
XLogP0.47
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[1-(aminomethyl)cyclohexyl]methyl]pyridin-2-amine
CID 103970402
N-[[3-(aminomethyl)oxetan-3-yl]methyl]pyridin-3-amine
CID 115249254
N'-pyridin-2-ylmethanediamine
CID 115225472
N-[[1-(chloromethyl)cyclohexyl]methyl]pyridin-2-amine
CID 103969232
N-[[3-(aminomethyl)oxetan-3-yl]methyl]-2-methyl-2-pyridin-3-ylpropan-1-amine
CID 115249662
N-[(1-propan-2-ylcyclopropyl)methyl]pyridin-2-amine
CID 103742931
N-(2-fluoroethyl)pyridin-2-amine
CID 23204810
N-[[3-(aminomethyl)oxetan-3-yl]methyl]-5-chlorothiophen-2-amine
CID 115249189
N-propylpyridin-2-amine
CID 91192651
N-[[4-(3-bromophenyl)oxan-4-yl]methyl]pyridin-2-amine
CID 167761666
N,N'-dipyridin-2-ylnonane-1,9-diamine
CID 86213861
N-[[3-(aminomethyl)oxetan-3-yl]methyl]-2-(2-bromophenyl)ethanamine
CID 115249596

Frequently Asked Questions

What is the IUPAC name of N-[[3-(aminomethyl)oxetan-3-yl]methyl]pyridin-2-amine?
The IUPAC name of N-[[3-(aminomethyl)oxetan-3-yl]methyl]pyridin-2-amine (CID 115249253) is N-[[3-(aminomethyl)oxetan-3-yl]methyl]pyridin-2-amine.
What is the SMILES notation for N-[[3-(aminomethyl)oxetan-3-yl]methyl]pyridin-2-amine?
The canonical SMILES for N-[[3-(aminomethyl)oxetan-3-yl]methyl]pyridin-2-amine is NCC1(CNc2ccccn2)COC1.
What is the InChIKey of N-[[3-(aminomethyl)oxetan-3-yl]methyl]pyridin-2-amine?
The InChIKey is ZQISAVAVUSSMKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c11-5-10(7-14-8-10)6-13-9-3-1-2-4-12-9/h1-4H,5-8,11H2,(H,12,13).
What are the key properties of N-[[3-(aminomethyl)oxetan-3-yl]methyl]pyridin-2-amine?
N-[[3-(aminomethyl)oxetan-3-yl]methyl]pyridin-2-amine has a molecular weight of 193.25 g/mol, XLogP of 0.47, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(aminomethyl)oxetan-3-yl]methyl]pyridin-2-amine is sourced from PubChem (CID 115249253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).