N-methyl-2-(pyridin-4-ylmethoxy)propan-1-amine

C10H16N2O — CID 62335696

IUPACN-methyl-2-(pyridin-4-ylmethoxy)propan-1-amine
SMILESCNCC(C)OCc1ccncc1
InChIInChI=1S/C10H16N2O/c1-9(7-11-2)13-8-10-3-5-12-6-4-10/h3-6,9,11H,7-8H2,1-2H3
InChIKeyPMMYOCIPHSFPKT-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.21
Rot. Bonds5

About N-methyl-2-(pyridin-4-ylmethoxy)propan-1-amine

N-methyl-2-(pyridin-4-ylmethoxy)propan-1-amine (PubChem CID 62335696) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is N-methyl-2-(pyridin-4-ylmethoxy)propan-1-amine.

Molecular Properties

Compound NameN-methyl-2-(pyridin-4-ylmethoxy)propan-1-amine
PubChem CID62335696
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC NameN-methyl-2-(pyridin-4-ylmethoxy)propan-1-amine
SMILESCNCC(C)OCc1ccncc1
InChIInChI=1S/C10H16N2O/c1-9(7-11-2)13-8-10-3-5-12-6-4-10/h3-6,9,11H,7-8H2,1-2H3
InChIKeyPMMYOCIPHSFPKT-UHFFFAOYSA-N
XLogP1.21
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 ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(propan-2-yloxymethyl)pyridine
CID 14442204
4-(pentan-2-yloxymethyl)pyridine
CID 59678333
methyl 2-(pyridin-4-ylmethoxy)propanoate
CID 83213951
N-(pyridin-4-ylmethoxy)methanamine
CID 87262654
N-methyl-2-(2-pyridin-3-ylethoxy)propan-1-amine
CID 63262792
N-methyl-2-(3-pyridin-4-ylpropoxy)butan-1-amine
CID 62450954
2-iodopropane;N-methyl-1-pyridin-4-ylmethanamine
CID 91308032
N-methyl-2-[4-(pentan-2-yloxymethyl)phenyl]propan-1-amine
CID 102987103
N-methyl-2,2-dipyridin-4-ylethanamine
CID 116824958
1-[1-(methylamino)propan-2-yloxy]-3-phenylmethoxypropan-2-ol
CID 106939509
2-[(4-chlorophenyl)methoxy]-N-propan-2-ylpropan-1-amine
CID 65125262
N-methyl-1-propan-2-yloxy-3-pyridin-4-ylpropan-2-amine
CID 79573917

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(pyridin-4-ylmethoxy)propan-1-amine?
The IUPAC name of N-methyl-2-(pyridin-4-ylmethoxy)propan-1-amine (CID 62335696) is N-methyl-2-(pyridin-4-ylmethoxy)propan-1-amine.
What is the SMILES notation for N-methyl-2-(pyridin-4-ylmethoxy)propan-1-amine?
The canonical SMILES for N-methyl-2-(pyridin-4-ylmethoxy)propan-1-amine is CNCC(C)OCc1ccncc1.
What is the InChIKey of N-methyl-2-(pyridin-4-ylmethoxy)propan-1-amine?
The InChIKey is PMMYOCIPHSFPKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-9(7-11-2)13-8-10-3-5-12-6-4-10/h3-6,9,11H,7-8H2,1-2H3.
What are the key properties of N-methyl-2-(pyridin-4-ylmethoxy)propan-1-amine?
N-methyl-2-(pyridin-4-ylmethoxy)propan-1-amine has a molecular weight of 180.25 g/mol, XLogP of 1.21, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(pyridin-4-ylmethoxy)propan-1-amine is sourced from PubChem (CID 62335696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).