N-methyl-1-(6-propyl-3-pyridinyl)methanamine

C10H16N2 — CID 142021922

IUPACN-methyl-1-(6-propyl-3-pyridinyl)methanamine
SMILESCCCc1ccc(CNC)cn1
InChIInChI=1S/C10H16N2/c1-3-4-10-6-5-9(7-11-2)8-12-10/h5-6,8,11H,3-4,7H2,1-2H3
InChIKeyXQUPBGGNCBSXDF-UHFFFAOYSA-N
MW164.25 g/mol
LogP1.75
Rot. Bonds4

About N-methyl-1-(6-propyl-3-pyridinyl)methanamine

N-methyl-1-(6-propyl-3-pyridinyl)methanamine (PubChem CID 142021922) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is N-methyl-1-(6-propyl-3-pyridinyl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(6-propyl-3-pyridinyl)methanamine
PubChem CID142021922
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC NameN-methyl-1-(6-propyl-3-pyridinyl)methanamine
SMILESCCCc1ccc(CNC)cn1
InChIInChI=1S/C10H16N2/c1-3-4-10-6-5-9(7-11-2)8-12-10/h5-6,8,11H,3-4,7H2,1-2H3
InChIKeyXQUPBGGNCBSXDF-UHFFFAOYSA-N
XLogP1.75
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Nicotine
CID 89594
Ethionamide
CID 2761171
Triprolidine
CID 5282443
Anabasine
CID 205586
3-Methylpyridine
CID 7970
(+-)-Dimethindene
CID 21855
Nornicotine
CID 91462
3-(1-Methylpyrrolidin-2-yl)pyridine
CID 942
Pheniramine
CID 4761
Prothionamide
CID 666418
3-(Pyrrolidin-2-yl)pyridine
CID 412
(+-)-Anabasine
CID 2181

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(6-propyl-3-pyridinyl)methanamine?
The IUPAC name of N-methyl-1-(6-propyl-3-pyridinyl)methanamine (CID 142021922) is N-methyl-1-(6-propyl-3-pyridinyl)methanamine.
What is the SMILES notation for N-methyl-1-(6-propyl-3-pyridinyl)methanamine?
The canonical SMILES for N-methyl-1-(6-propyl-3-pyridinyl)methanamine is CCCc1ccc(CNC)cn1.
What is the InChIKey of N-methyl-1-(6-propyl-3-pyridinyl)methanamine?
The InChIKey is XQUPBGGNCBSXDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2/c1-3-4-10-6-5-9(7-11-2)8-12-10/h5-6,8,11H,3-4,7H2,1-2H3.
What are the key properties of N-methyl-1-(6-propyl-3-pyridinyl)methanamine?
N-methyl-1-(6-propyl-3-pyridinyl)methanamine has a molecular weight of 164.25 g/mol, XLogP of 1.75, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(6-propyl-3-pyridinyl)methanamine is sourced from PubChem (CID 142021922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).