N-methyl-1-(4-propoxy-3-pyridinyl)methanamine

C10H16N2O — CID 81255157

IUPACN-methyl-1-(4-propoxy-3-pyridinyl)methanamine
SMILESCCCOc1ccncc1CNC
InChIInChI=1S/C10H16N2O/c1-3-6-13-10-4-5-12-8-9(10)7-11-2/h4-5,8,11H,3,6-7H2,1-2H3
InChIKeyBPIQHHNDPVQXFY-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.59
Rot. Bonds5

About N-methyl-1-(4-propoxy-3-pyridinyl)methanamine

N-methyl-1-(4-propoxy-3-pyridinyl)methanamine (PubChem CID 81255157) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is N-methyl-1-(4-propoxy-3-pyridinyl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(4-propoxy-3-pyridinyl)methanamine
PubChem CID81255157
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC NameN-methyl-1-(4-propoxy-3-pyridinyl)methanamine
SMILESCCCOc1ccncc1CNC
InChIInChI=1S/C10H16N2O/c1-3-6-13-10-4-5-12-8-9(10)7-11-2/h4-5,8,11H,3,6-7H2,1-2H3
InChIKeyBPIQHHNDPVQXFY-UHFFFAOYSA-N
XLogP1.59
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-[(4-propoxy-3-pyridinyl)methyl]propan-2-amine
CID 81255020
1-(4-but-3-enoxy-3-pyridinyl)-N-methylmethanamine
CID 81254371
N-[(4-hexoxy-3-pyridinyl)methyl]ethanamine
CID 81255386
N,N,2-trimethyl-1-[[3-(methylaminomethyl)-4-pyridinyl]oxy]propan-2-amine
CID 81250555
1-[4-[(2-fluorophenyl)methoxy]-3-pyridinyl]-N-methylmethanamine
CID 81251244
N-[(4-ethoxy-3-pyridinyl)methyl]propan-1-amine
CID 81253184
3-ethoxy-4-propoxypyridine
CID 90961233
N-methyl-1-(5-methyl-2-propoxyphenyl)methanamine
CID 63323239
N-[[4-(3,3,3-trifluoropropoxy)-3-pyridinyl]methyl]propan-1-amine
CID 82957136
N-[(4-heptoxy-3-pyridinyl)methyl]-2-methylpropan-1-amine
CID 81254076
N,N-diethyl-2-[[4-(methylaminomethyl)-3-pyridinyl]oxy]ethanamine
CID 105075378
N-methyl-1-[3-(3-methylbutoxy)-4-pyridinyl]methanamine
CID 105074964

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(4-propoxy-3-pyridinyl)methanamine?
The IUPAC name of N-methyl-1-(4-propoxy-3-pyridinyl)methanamine (CID 81255157) is N-methyl-1-(4-propoxy-3-pyridinyl)methanamine.
What is the SMILES notation for N-methyl-1-(4-propoxy-3-pyridinyl)methanamine?
The canonical SMILES for N-methyl-1-(4-propoxy-3-pyridinyl)methanamine is CCCOc1ccncc1CNC.
What is the InChIKey of N-methyl-1-(4-propoxy-3-pyridinyl)methanamine?
The InChIKey is BPIQHHNDPVQXFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-3-6-13-10-4-5-12-8-9(10)7-11-2/h4-5,8,11H,3,6-7H2,1-2H3.
What are the key properties of N-methyl-1-(4-propoxy-3-pyridinyl)methanamine?
N-methyl-1-(4-propoxy-3-pyridinyl)methanamine has a molecular weight of 180.25 g/mol, XLogP of 1.59, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(4-propoxy-3-pyridinyl)methanamine is sourced from PubChem (CID 81255157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).