6-methoxy-4-methyl-N-propyl-1-pyridin-4-ylhexan-3-amine

C16H28N2O — CID 105185077

IUPAC6-methoxy-4-methyl-N-propyl-1-pyridin-4-ylhexan-3-amine
SMILESCCCNC(CCc1ccncc1)C(C)CCOC
InChIInChI=1S/C16H28N2O/c1-4-10-18-16(14(2)9-13-19-3)6-5-15-7-11-17-12-8-15/h7-8,11-12,14,16,18H,4-6,9-10,13H2,1-3H3
InChIKeyONFKKPJOUQWNJA-UHFFFAOYSA-N
MW264.41 g/mol
LogP3.06
Rot. Bonds10

About 6-methoxy-4-methyl-N-propyl-1-pyridin-4-ylhexan-3-amine

6-methoxy-4-methyl-N-propyl-1-pyridin-4-ylhexan-3-amine (PubChem CID 105185077) has the molecular formula C16H28N2O and a molecular weight of 264.41 g/mol. Its IUPAC name is 6-methoxy-4-methyl-N-propyl-1-pyridin-4-ylhexan-3-amine.

Molecular Properties

Compound Name6-methoxy-4-methyl-N-propyl-1-pyridin-4-ylhexan-3-amine
PubChem CID105185077
Molecular FormulaC16H28N2O
Molecular Weight264.41 g/mol
Exact Mass264.22
IUPAC Name6-methoxy-4-methyl-N-propyl-1-pyridin-4-ylhexan-3-amine
SMILESCCCNC(CCc1ccncc1)C(C)CCOC
InChIInChI=1S/C16H28N2O/c1-4-10-18-16(14(2)9-13-19-3)6-5-15-7-11-17-12-8-15/h7-8,11-12,14,16,18H,4-6,9-10,13H2,1-3H3
InChIKeyONFKKPJOUQWNJA-UHFFFAOYSA-N
XLogP3.06
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.41
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methoxy-N-propyl-1-pyridin-4-ylbutan-2-amine
CID 62605290
(5-methoxy-3-methyl-1-pyridin-4-ylpentan-2-yl)hydrazine
CID 105212316
1-methoxy-3-methyl-N-(2-pyridin-4-ylethyl)butan-2-amine
CID 65049563
4-methyl-1-(4-methylphenyl)-N-propylheptan-3-amine
CID 107893980
6-methoxy-1-(2-methoxyethoxy)-4-methyl-N-propylhexan-3-amine
CID 102928662
1,5-dimethoxy-2-methyl-N-propylpentan-3-amine
CID 165348363
1-(2,3-difluorophenyl)-5-methoxy-3-methyl-N-propylpentan-2-amine
CID 105044273
1,1-dimethoxy-N-propyl-3-pyridin-4-ylpropan-2-amine
CID 79493387
6-methoxy-4-methyl-1-(3-methylphenoxy)-N-propylhexan-3-amine
CID 105185190
N-(2-methoxyethyl)-2-(2-pyridin-4-ylethylamino)propanamide
CID 60902705
6-methoxy-4-methyl-N-propyl-1-(2,2,2-trifluoroethoxy)hexan-3-amine
CID 103148773
4-methoxy-1-(4-methoxyphenyl)-N-propylpentan-3-amine
CID 79615993

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-4-methyl-N-propyl-1-pyridin-4-ylhexan-3-amine?
The IUPAC name of 6-methoxy-4-methyl-N-propyl-1-pyridin-4-ylhexan-3-amine (CID 105185077) is 6-methoxy-4-methyl-N-propyl-1-pyridin-4-ylhexan-3-amine.
What is the SMILES notation for 6-methoxy-4-methyl-N-propyl-1-pyridin-4-ylhexan-3-amine?
The canonical SMILES for 6-methoxy-4-methyl-N-propyl-1-pyridin-4-ylhexan-3-amine is CCCNC(CCc1ccncc1)C(C)CCOC.
What is the InChIKey of 6-methoxy-4-methyl-N-propyl-1-pyridin-4-ylhexan-3-amine?
The InChIKey is ONFKKPJOUQWNJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O/c1-4-10-18-16(14(2)9-13-19-3)6-5-15-7-11-17-12-8-15/h7-8,11-12,14,16,18H,4-6,9-10,13H2,1-3H3.
What are the key properties of 6-methoxy-4-methyl-N-propyl-1-pyridin-4-ylhexan-3-amine?
6-methoxy-4-methyl-N-propyl-1-pyridin-4-ylhexan-3-amine has a molecular weight of 264.41 g/mol, XLogP of 3.06, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-4-methyl-N-propyl-1-pyridin-4-ylhexan-3-amine is sourced from PubChem (CID 105185077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).