N-methyl-1-[6-(4-methylazepan-1-yl)-2-pyridinyl]methanamine

C14H23N3 — CID 63626658

IUPACN-methyl-1-[6-(4-methylazepan-1-yl)-2-pyridinyl]methanamine
SMILESCNCc1cccc(N2CCCC(C)CC2)n1
InChIInChI=1S/C14H23N3/c1-12-5-4-9-17(10-8-12)14-7-3-6-13(16-14)11-15-2/h3,6-7,12,15H,4-5,8-11H2,1-2H3
InChIKeyURNAILHPIUVEBF-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.43
Rot. Bonds3

About N-methyl-1-[6-(4-methylazepan-1-yl)-2-pyridinyl]methanamine

N-methyl-1-[6-(4-methylazepan-1-yl)-2-pyridinyl]methanamine (PubChem CID 63626658) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is N-methyl-1-[6-(4-methylazepan-1-yl)-2-pyridinyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[6-(4-methylazepan-1-yl)-2-pyridinyl]methanamine
PubChem CID63626658
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC NameN-methyl-1-[6-(4-methylazepan-1-yl)-2-pyridinyl]methanamine
SMILESCNCc1cccc(N2CCCC(C)CC2)n1
InChIInChI=1S/C14H23N3/c1-12-5-4-9-17(10-8-12)14-7-3-6-13(16-14)11-15-2/h3,6-7,12,15H,4-5,8-11H2,1-2H3
InChIKeyURNAILHPIUVEBF-UHFFFAOYSA-N
XLogP2.43
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[6-(4-methylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine
CID 62286089
2-methyl-N-[[6-(3-methylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine
CID 62285603
1-[6-(4,4-diethylpiperidin-1-yl)-2-pyridinyl]-N-methylmethanamine
CID 55158715
N-methyl-1-[6-(3-phenylpyrrolidin-1-yl)-2-pyridinyl]methanamine
CID 62285538
1-[6-(3,4-dimethylpiperazin-1-yl)-2-pyridinyl]-N-methylmethanamine
CID 63621802
1-[6-(2-cyclopentylpyrrolidin-1-yl)-2-pyridinyl]-N-methylmethanamine
CID 62294232
N,N-diethyl-1-[6-(methylaminomethyl)-2-pyridinyl]pyrrolidin-3-amine
CID 63169150
N-methyl-1-[2-(4-methylazepan-1-yl)quinolin-4-yl]methanamine
CID 63625591
2-methyl-N-[[6-(3-methylpyrrolidin-1-yl)-2-pyridinyl]methyl]propan-2-amine
CID 62284200
1-[2-chloro-6-(4-methylazepan-1-yl)phenyl]-N-methylmethanamine
CID 63624469
N-[[6-(4-methylazepan-1-yl)pyrazin-2-yl]methyl]ethanamine
CID 66449329
N-methyl-1-[1-(4-methylazepan-1-yl)isoquinolin-4-yl]methanamine
CID 106776173

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[6-(4-methylazepan-1-yl)-2-pyridinyl]methanamine?
The IUPAC name of N-methyl-1-[6-(4-methylazepan-1-yl)-2-pyridinyl]methanamine (CID 63626658) is N-methyl-1-[6-(4-methylazepan-1-yl)-2-pyridinyl]methanamine.
What is the SMILES notation for N-methyl-1-[6-(4-methylazepan-1-yl)-2-pyridinyl]methanamine?
The canonical SMILES for N-methyl-1-[6-(4-methylazepan-1-yl)-2-pyridinyl]methanamine is CNCc1cccc(N2CCCC(C)CC2)n1.
What is the InChIKey of N-methyl-1-[6-(4-methylazepan-1-yl)-2-pyridinyl]methanamine?
The InChIKey is URNAILHPIUVEBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-12-5-4-9-17(10-8-12)14-7-3-6-13(16-14)11-15-2/h3,6-7,12,15H,4-5,8-11H2,1-2H3.
What are the key properties of N-methyl-1-[6-(4-methylazepan-1-yl)-2-pyridinyl]methanamine?
N-methyl-1-[6-(4-methylazepan-1-yl)-2-pyridinyl]methanamine has a molecular weight of 233.36 g/mol, XLogP of 2.43, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[6-(4-methylazepan-1-yl)-2-pyridinyl]methanamine is sourced from PubChem (CID 63626658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).