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

C13H21N3 — CID 63888634

IUPAC[4-[(2-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine
SMILESCC1CCCCN1Cc1ccnc(CN)c1
InChIInChI=1S/C13H21N3/c1-11-4-2-3-7-16(11)10-12-5-6-15-13(8-12)9-14/h5-6,8,11H,2-4,7,9-10,14H2,1H3
InChIKeyKOZGHYRCOCKLEG-UHFFFAOYSA-N
MW219.33 g/mol
LogP1.91
Rot. Bonds3

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

[4-[(2-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine (PubChem CID 63888634) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is [4-[(2-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[4-[(2-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine
PubChem CID63888634
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC Name[4-[(2-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine
SMILESCC1CCCCN1Cc1ccnc(CN)c1
InChIInChI=1S/C13H21N3/c1-11-4-2-3-7-16(11)10-12-5-6-15-13(8-12)9-14/h5-6,8,11H,2-4,7,9-10,14H2,1H3
InChIKeyKOZGHYRCOCKLEG-UHFFFAOYSA-N
XLogP1.91
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 ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[4-[(2,4-dimethylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine
CID 63888056
[4-[(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)methyl]-2-pyridinyl]methanamine
CID 79930626
[4-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-ylmethyl)-2-pyridinyl]methanamine
CID 63888042
2-chloro-4-[(2-methylpyrrolidin-1-yl)methyl]pyridine
CID 62471451
[4-[(3-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine
CID 63888835
[2-methoxy-5-[(2-methylpiperidin-1-yl)methyl]phenyl]methanamine
CID 65341173
1-(furan-3-ylmethyl)-2-methylpiperidine
CID 131067183
[4-[(4-piperidin-1-ylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine
CID 63887071
1-[(4-iodophenyl)methyl]-2-methylpiperidine
CID 65477935
2,6-ditert-butyl-4-[[(2S)-2-methylpiperidin-1-yl]methyl]phenol
CID 7444975
4-[[(2R)-2-methylpiperidin-1-yl]methyl]benzenethiol
CID 97294059
[4-[(4-methylpiperazin-1-yl)methyl]-2-pyridinyl]methanamine
CID 63888635

Frequently Asked Questions

What is the IUPAC name of [4-[(2-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine?
The IUPAC name of [4-[(2-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine (CID 63888634) is [4-[(2-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine.
What is the SMILES notation for [4-[(2-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine?
The canonical SMILES for [4-[(2-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine is CC1CCCCN1Cc1ccnc(CN)c1.
What is the InChIKey of [4-[(2-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine?
The InChIKey is KOZGHYRCOCKLEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-11-4-2-3-7-16(11)10-12-5-6-15-13(8-12)9-14/h5-6,8,11H,2-4,7,9-10,14H2,1H3.
What are the key properties of [4-[(2-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine?
[4-[(2-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine has a molecular weight of 219.33 g/mol, XLogP of 1.91, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(2-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine is sourced from PubChem (CID 63888634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).