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

C13H21N3 — CID 63888835

IUPAC[4-[(3-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine
SMILESCC1CCCN(Cc2ccnc(CN)c2)C1
InChIInChI=1S/C13H21N3/c1-11-3-2-6-16(9-11)10-12-4-5-15-13(7-12)8-14/h4-5,7,11H,2-3,6,8-10,14H2,1H3
InChIKeyDNWYBNZCSKDUBH-UHFFFAOYSA-N
MW219.33 g/mol
LogP1.77
Rot. Bonds3

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

[4-[(3-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine (PubChem CID 63888835) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is [4-[(3-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[4-[(3-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine
PubChem CID63888835
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC Name[4-[(3-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine
SMILESCC1CCCN(Cc2ccnc(CN)c2)C1
InChIInChI=1S/C13H21N3/c1-11-3-2-6-16(9-11)10-12-4-5-15-13(7-12)8-14/h4-5,7,11H,2-3,6,8-10,14H2,1H3
InChIKeyDNWYBNZCSKDUBH-UHFFFAOYSA-N
XLogP1.77
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-[[2-(aminomethyl)-4-pyridinyl]methyl]piperidin-3-yl]methanol
CID 63887461
4-[(3-methylpiperidin-1-yl)methyl]pyridine
CID 121401070
1-[[2-(aminomethyl)-4-pyridinyl]methyl]piperidine-3-carboxamide
CID 63889418
[4-[(3-propoxypiperidin-1-yl)methyl]-2-pyridinyl]methanamine
CID 63888050
[4-[(3-propylpyrrolidin-1-yl)methyl]-2-pyridinyl]methanamine
CID 113417036
1-[[2-(aminomethyl)-4-pyridinyl]methyl]-N,N-diethylpyrrolidin-3-amine
CID 63888264
[2-methoxy-5-[(3-methylpiperidin-1-yl)methyl]phenyl]methanamine
CID 65341268
[4-[(2-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine
CID 63888634
[4-[(4-methylpiperazin-1-yl)methyl]-2-pyridinyl]methanamine
CID 63888635
4-[[(3S)-3-methylpiperidin-1-yl]methyl]aniline
CID 28720719
1-benzyl-3-methylpiperidine
CID 2794856
[4-[(4-piperidin-1-ylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine
CID 63887071

Frequently Asked Questions

What is the IUPAC name of [4-[(3-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine?
The IUPAC name of [4-[(3-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine (CID 63888835) is [4-[(3-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine.
What is the SMILES notation for [4-[(3-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine?
The canonical SMILES for [4-[(3-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine is CC1CCCN(Cc2ccnc(CN)c2)C1.
What is the InChIKey of [4-[(3-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine?
The InChIKey is DNWYBNZCSKDUBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-11-3-2-6-16(9-11)10-12-4-5-15-13(7-12)8-14/h4-5,7,11H,2-3,6,8-10,14H2,1H3.
What are the key properties of [4-[(3-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine?
[4-[(3-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine has a molecular weight of 219.33 g/mol, XLogP of 1.77, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(3-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine is sourced from PubChem (CID 63888835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).