[4-methyl-1-(4-methyl-2-pyridinyl)piperidin-3-yl]methanamine

C13H21N3 — CID 114961622

IUPAC[4-methyl-1-(4-methyl-2-pyridinyl)piperidin-3-yl]methanamine
SMILESCc1ccnc(N2CCC(C)C(CN)C2)c1
InChIInChI=1S/C13H21N3/c1-10-3-5-15-13(7-10)16-6-4-11(2)12(8-14)9-16/h3,5,7,11-12H,4,6,8-9,14H2,1-2H3
InChIKeyXFTQTUPGZWRCPN-UHFFFAOYSA-N
MW219.33 g/mol
LogP1.81
Rot. Bonds2

About [4-methyl-1-(4-methyl-2-pyridinyl)piperidin-3-yl]methanamine

[4-methyl-1-(4-methyl-2-pyridinyl)piperidin-3-yl]methanamine (PubChem CID 114961622) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is [4-methyl-1-(4-methyl-2-pyridinyl)piperidin-3-yl]methanamine.

Molecular Properties

Compound Name[4-methyl-1-(4-methyl-2-pyridinyl)piperidin-3-yl]methanamine
PubChem CID114961622
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC Name[4-methyl-1-(4-methyl-2-pyridinyl)piperidin-3-yl]methanamine
SMILESCc1ccnc(N2CCC(C)C(CN)C2)c1
InChIInChI=1S/C13H21N3/c1-10-3-5-15-13(7-10)16-6-4-11(2)12(8-14)9-16/h3,5,7,11-12H,4,6,8-9,14H2,1-2H3
InChIKeyXFTQTUPGZWRCPN-UHFFFAOYSA-N
XLogP1.81
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-1-(4-methyl-2-pyridinyl)piperidin-4-amine
CID 79868133
1-(4-methyl-2-pyridinyl)pyrrolidin-3-ol
CID 62917147
[(3S)-1-(4-methyl-2-pyridinyl)pyrrolidin-3-yl]methanol
CID 94407847
ethane;2-(3-ethylpyrrolidin-1-yl)-4-methylpyridine
CID 170578415
[1-(5-bromo-2-pyridinyl)-4-methylpiperidin-3-yl]methanamine
CID 114961588
2-[1-(4-methyl-2-pyridinyl)piperidin-4-yl]ethanamine;hydrochloride
CID 22064868
2-[3-(aminomethyl)-4-methylpiperidin-1-yl]-4-methylbenzonitrile
CID 114961752
2-(3-bromo-4-methylpyrrolidin-1-yl)-4-methylpyridine
CID 130948414
2-[4-(bromomethyl)piperidin-1-yl]-4-methylpyridine
CID 80668447
N-methyl-1-(4-methyl-2-pyridinyl)piperidin-3-amine
CID 62547429
[1-(5-bromopyrimidin-2-yl)-4-methylpiperidin-3-yl]methanamine
CID 114961719
N-methylmethanimine;1-(4-methyl-2-pyridinyl)piperidin-4-amine
CID 143465241

Frequently Asked Questions

What is the IUPAC name of [4-methyl-1-(4-methyl-2-pyridinyl)piperidin-3-yl]methanamine?
The IUPAC name of [4-methyl-1-(4-methyl-2-pyridinyl)piperidin-3-yl]methanamine (CID 114961622) is [4-methyl-1-(4-methyl-2-pyridinyl)piperidin-3-yl]methanamine.
What is the SMILES notation for [4-methyl-1-(4-methyl-2-pyridinyl)piperidin-3-yl]methanamine?
The canonical SMILES for [4-methyl-1-(4-methyl-2-pyridinyl)piperidin-3-yl]methanamine is Cc1ccnc(N2CCC(C)C(CN)C2)c1.
What is the InChIKey of [4-methyl-1-(4-methyl-2-pyridinyl)piperidin-3-yl]methanamine?
The InChIKey is XFTQTUPGZWRCPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-10-3-5-15-13(7-10)16-6-4-11(2)12(8-14)9-16/h3,5,7,11-12H,4,6,8-9,14H2,1-2H3.
What are the key properties of [4-methyl-1-(4-methyl-2-pyridinyl)piperidin-3-yl]methanamine?
[4-methyl-1-(4-methyl-2-pyridinyl)piperidin-3-yl]methanamine has a molecular weight of 219.33 g/mol, XLogP of 1.81, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methyl-1-(4-methyl-2-pyridinyl)piperidin-3-yl]methanamine is sourced from PubChem (CID 114961622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).