N-[[3-(methoxymethyl)piperidin-3-yl]methyl]-5-methylpyridin-2-amine

C14H23N3O — CID 114280911

IUPACN-[[3-(methoxymethyl)piperidin-3-yl]methyl]-5-methylpyridin-2-amine
SMILESCOCC1(CNc2ccc(C)cn2)CCCNC1
InChIInChI=1S/C14H23N3O/c1-12-4-5-13(16-8-12)17-10-14(11-18-2)6-3-7-15-9-14/h4-5,8,15H,3,6-7,9-11H2,1-2H3,(H,16,17)
InChIKeyAPBIKDHERKLBNG-UHFFFAOYSA-N
MW249.36 g/mol
LogP1.82
Rot. Bonds5

About N-[[3-(methoxymethyl)piperidin-3-yl]methyl]-5-methylpyridin-2-amine

N-[[3-(methoxymethyl)piperidin-3-yl]methyl]-5-methylpyridin-2-amine (PubChem CID 114280911) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is N-[[3-(methoxymethyl)piperidin-3-yl]methyl]-5-methylpyridin-2-amine.

Molecular Properties

Compound NameN-[[3-(methoxymethyl)piperidin-3-yl]methyl]-5-methylpyridin-2-amine
PubChem CID114280911
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC NameN-[[3-(methoxymethyl)piperidin-3-yl]methyl]-5-methylpyridin-2-amine
SMILESCOCC1(CNc2ccc(C)cn2)CCCNC1
InChIInChI=1S/C14H23N3O/c1-12-4-5-13(16-8-12)17-10-14(11-18-2)6-3-7-15-9-14/h4-5,8,15H,3,6-7,9-11H2,1-2H3,(H,16,17)
InChIKeyAPBIKDHERKLBNG-UHFFFAOYSA-N
XLogP1.82
TPSA46.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1-ethylcyclopropyl)methyl]-5-methylpyridin-2-amine
CID 103736819
3-[(2-fluorophenyl)methyl]-3-(methoxymethyl)piperidine
CID 67983211
N-[[(4R)-3,3-difluoropiperidin-4-yl]methyl]-5-methylpyridin-2-amine
CID 134542653
N-(azetidin-3-ylmethyl)-5-methylpyridin-2-amine
CID 130987495
N-[[1-(aminomethyl)cyclopentyl]methyl]-5-tert-butylpyridin-2-amine
CID 107875696
5-methyl-N-(2-piperidin-4-ylethyl)pyridin-2-amine
CID 83837473
N'-(5-methyl-2-pyridinyl)methanediamine
CID 137383083
5-methyl-N-(1-methylcyclopentyl)pyridin-2-amine
CID 61368893
1-N-(5-methyl-2-pyridinyl)butane-1,2-diamine
CID 63732659
5-methoxy-N-[(1-methylcyclopropyl)methyl]pyridin-2-amine
CID 107143616
3-[[(5-methyl-2-pyridinyl)amino]methyl]oxolan-3-ol
CID 103847710
5-bromo-N-[[1-(chloromethyl)cyclopentyl]methyl]pyridin-2-amine
CID 115363614

Frequently Asked Questions

What is the IUPAC name of N-[[3-(methoxymethyl)piperidin-3-yl]methyl]-5-methylpyridin-2-amine?
The IUPAC name of N-[[3-(methoxymethyl)piperidin-3-yl]methyl]-5-methylpyridin-2-amine (CID 114280911) is N-[[3-(methoxymethyl)piperidin-3-yl]methyl]-5-methylpyridin-2-amine.
What is the SMILES notation for N-[[3-(methoxymethyl)piperidin-3-yl]methyl]-5-methylpyridin-2-amine?
The canonical SMILES for N-[[3-(methoxymethyl)piperidin-3-yl]methyl]-5-methylpyridin-2-amine is COCC1(CNc2ccc(C)cn2)CCCNC1.
What is the InChIKey of N-[[3-(methoxymethyl)piperidin-3-yl]methyl]-5-methylpyridin-2-amine?
The InChIKey is APBIKDHERKLBNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-12-4-5-13(16-8-12)17-10-14(11-18-2)6-3-7-15-9-14/h4-5,8,15H,3,6-7,9-11H2,1-2H3,(H,16,17).
What are the key properties of N-[[3-(methoxymethyl)piperidin-3-yl]methyl]-5-methylpyridin-2-amine?
N-[[3-(methoxymethyl)piperidin-3-yl]methyl]-5-methylpyridin-2-amine has a molecular weight of 249.36 g/mol, XLogP of 1.82, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(methoxymethyl)piperidin-3-yl]methyl]-5-methylpyridin-2-amine is sourced from PubChem (CID 114280911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).