2-methyl-N-[[6-methyl-4-(3-methylpyrrolidin-1-yl)-3-pyridinyl]methyl]propan-1-amine

C16H27N3 — CID 81246198

IUPAC2-methyl-N-[[6-methyl-4-(3-methylpyrrolidin-1-yl)-3-pyridinyl]methyl]propan-1-amine
SMILESCc1cc(N2CCC(C)C2)c(CNCC(C)C)cn1
InChIInChI=1S/C16H27N3/c1-12(2)8-17-9-15-10-18-14(4)7-16(15)19-6-5-13(3)11-19/h7,10,12-13,17H,5-6,8-9,11H2,1-4H3
InChIKeyIOIMNPSBTMRWLS-UHFFFAOYSA-N
MW261.41 g/mol
LogP2.98
Rot. Bonds5

About 2-methyl-N-[[6-methyl-4-(3-methylpyrrolidin-1-yl)-3-pyridinyl]methyl]propan-1-amine

2-methyl-N-[[6-methyl-4-(3-methylpyrrolidin-1-yl)-3-pyridinyl]methyl]propan-1-amine (PubChem CID 81246198) has the molecular formula C16H27N3 and a molecular weight of 261.41 g/mol. Its IUPAC name is 2-methyl-N-[[6-methyl-4-(3-methylpyrrolidin-1-yl)-3-pyridinyl]methyl]propan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[[6-methyl-4-(3-methylpyrrolidin-1-yl)-3-pyridinyl]methyl]propan-1-amine
PubChem CID81246198
Molecular FormulaC16H27N3
Molecular Weight261.41 g/mol
Exact Mass261.22
IUPAC Name2-methyl-N-[[6-methyl-4-(3-methylpyrrolidin-1-yl)-3-pyridinyl]methyl]propan-1-amine
SMILESCc1cc(N2CCC(C)C2)c(CNCC(C)C)cn1
InChIInChI=1S/C16H27N3/c1-12(2)8-17-9-15-10-18-14(4)7-16(15)19-6-5-13(3)11-19/h7,10,12-13,17H,5-6,8-9,11H2,1-4H3
InChIKeyIOIMNPSBTMRWLS-UHFFFAOYSA-N
XLogP2.98
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-methyl-N-[[6-methyl-4-(3-methylpyrrolidin-1-yl)-3-pyridinyl]methyl]propan-1-amine with MolForge

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Related Compounds

N-methyl-1-[6-methyl-4-(3-methylpyrrolidin-1-yl)-3-pyridinyl]methanamine
CID 81246576
N-[[4-(2,4-dimethylpiperidin-1-yl)-6-methyl-3-pyridinyl]methyl]-2-methylpropan-1-amine
CID 81253411
N-[[6-methyl-4-(4-methylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine
CID 81249357
2-methyl-N-[[6-methyl-4-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)-3-pyridinyl]methyl]propan-1-amine
CID 114412754
N-[[6-methyl-4-(4-propan-2-ylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine
CID 103502997
N-[[4,6-dimethyl-2-(3-methylpyrrolidin-1-yl)-3-pyridinyl]methyl]-2-methylpropan-1-amine
CID 62284032
5-(chloromethyl)-2-methyl-4-(4-methylpiperidin-1-yl)pyridine
CID 81237792
N-[[4-(3-ethylpiperidin-1-yl)-6-methyl-3-pyridinyl]methyl]ethanamine
CID 81246490
N-[[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-6-methyl-3-pyridinyl]methyl]ethanamine
CID 104960865
2-methyl-N-[[6-(4-methylpiperidin-1-yl)-3-pyridinyl]methyl]propan-1-amine
CID 60777709
N-[[4-(2,5-dimethylpiperidin-1-yl)-6-methyl-3-pyridinyl]methyl]propan-1-amine
CID 81247735
N-[[4-(3-methoxypiperidin-1-yl)-6-methyl-3-pyridinyl]methyl]ethanamine
CID 102967869

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[6-methyl-4-(3-methylpyrrolidin-1-yl)-3-pyridinyl]methyl]propan-1-amine?
The IUPAC name of 2-methyl-N-[[6-methyl-4-(3-methylpyrrolidin-1-yl)-3-pyridinyl]methyl]propan-1-amine (CID 81246198) is 2-methyl-N-[[6-methyl-4-(3-methylpyrrolidin-1-yl)-3-pyridinyl]methyl]propan-1-amine.
What is the SMILES notation for 2-methyl-N-[[6-methyl-4-(3-methylpyrrolidin-1-yl)-3-pyridinyl]methyl]propan-1-amine?
The canonical SMILES for 2-methyl-N-[[6-methyl-4-(3-methylpyrrolidin-1-yl)-3-pyridinyl]methyl]propan-1-amine is Cc1cc(N2CCC(C)C2)c(CNCC(C)C)cn1.
What is the InChIKey of 2-methyl-N-[[6-methyl-4-(3-methylpyrrolidin-1-yl)-3-pyridinyl]methyl]propan-1-amine?
The InChIKey is IOIMNPSBTMRWLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3/c1-12(2)8-17-9-15-10-18-14(4)7-16(15)19-6-5-13(3)11-19/h7,10,12-13,17H,5-6,8-9,11H2,1-4H3.
What are the key properties of 2-methyl-N-[[6-methyl-4-(3-methylpyrrolidin-1-yl)-3-pyridinyl]methyl]propan-1-amine?
2-methyl-N-[[6-methyl-4-(3-methylpyrrolidin-1-yl)-3-pyridinyl]methyl]propan-1-amine has a molecular weight of 261.41 g/mol, XLogP of 2.98, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[6-methyl-4-(3-methylpyrrolidin-1-yl)-3-pyridinyl]methyl]propan-1-amine is sourced from PubChem (CID 81246198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).