1-methyl-N-[(3-methyl-4-pyridinyl)methyl]piperidin-3-amine

C13H21N3 — CID 114699054

IUPAC1-methyl-N-[(3-methyl-4-pyridinyl)methyl]piperidin-3-amine
SMILESCc1cnccc1CNC1CCCN(C)C1
InChIInChI=1S/C13H21N3/c1-11-8-14-6-5-12(11)9-15-13-4-3-7-16(2)10-13/h5-6,8,13,15H,3-4,7,9-10H2,1-2H3
InChIKeyCQXSFBSHRBFHMV-UHFFFAOYSA-N
MW219.33 g/mol
LogP1.57
Rot. Bonds3

About 1-methyl-N-[(3-methyl-4-pyridinyl)methyl]piperidin-3-amine

1-methyl-N-[(3-methyl-4-pyridinyl)methyl]piperidin-3-amine (PubChem CID 114699054) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is 1-methyl-N-[(3-methyl-4-pyridinyl)methyl]piperidin-3-amine.

Molecular Properties

Compound Name1-methyl-N-[(3-methyl-4-pyridinyl)methyl]piperidin-3-amine
PubChem CID114699054
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC Name1-methyl-N-[(3-methyl-4-pyridinyl)methyl]piperidin-3-amine
SMILESCc1cnccc1CNC1CCCN(C)C1
InChIInChI=1S/C13H21N3/c1-11-8-14-6-5-12(11)9-15-13-4-3-7-16(2)10-13/h5-6,8,13,15H,3-4,7,9-10H2,1-2H3
InChIKeyCQXSFBSHRBFHMV-UHFFFAOYSA-N
XLogP1.57
TPSA28.16 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 ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2,5-dimethylphenyl)methyl]-1-methylpiperidin-3-amine
CID 54971762
1-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidin-3-amine
CID 61210854
N-[(3-methyl-4-pyridinyl)methyl]-3-propan-2-ylcyclohexan-1-amine
CID 107448832
N-[(3-methyl-4-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-amine
CID 114698856
3-methyl-N-[(3-methyl-4-pyridinyl)methyl]cyclopentan-1-amine
CID 114699208
3-[(3-methyl-4-pyridinyl)methylamino]cyclohexane-1-carboxylic acid
CID 114699082
N-[(3,4-dimethylphenyl)methyl]-1-methylpiperidin-3-amine
CID 61211231
N-[(2,3-difluorophenyl)methyl]-1-methylpiperidin-3-amine
CID 63667562
N-[(3-methyl-4-pyridinyl)methyl]-4-phenylcyclohexan-1-amine
CID 114698974
1-methyl-N-[(1-methylpyrrol-3-yl)methyl]piperidin-3-amine
CID 66400036
N-[(2-ethylpyrazol-3-yl)methyl]-1-methylpiperidin-3-amine
CID 115762067
N-[(3-chloro-2-fluorophenyl)methyl]-1-methylpiperidin-3-amine
CID 115695883

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[(3-methyl-4-pyridinyl)methyl]piperidin-3-amine?
The IUPAC name of 1-methyl-N-[(3-methyl-4-pyridinyl)methyl]piperidin-3-amine (CID 114699054) is 1-methyl-N-[(3-methyl-4-pyridinyl)methyl]piperidin-3-amine.
What is the SMILES notation for 1-methyl-N-[(3-methyl-4-pyridinyl)methyl]piperidin-3-amine?
The canonical SMILES for 1-methyl-N-[(3-methyl-4-pyridinyl)methyl]piperidin-3-amine is Cc1cnccc1CNC1CCCN(C)C1.
What is the InChIKey of 1-methyl-N-[(3-methyl-4-pyridinyl)methyl]piperidin-3-amine?
The InChIKey is CQXSFBSHRBFHMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-11-8-14-6-5-12(11)9-15-13-4-3-7-16(2)10-13/h5-6,8,13,15H,3-4,7,9-10H2,1-2H3.
What are the key properties of 1-methyl-N-[(3-methyl-4-pyridinyl)methyl]piperidin-3-amine?
1-methyl-N-[(3-methyl-4-pyridinyl)methyl]piperidin-3-amine has a molecular weight of 219.33 g/mol, XLogP of 1.57, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[(3-methyl-4-pyridinyl)methyl]piperidin-3-amine is sourced from PubChem (CID 114699054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).