1-methoxy-N-propylhexan-3-amine

C10H23NO — CID 61412304

IUPAC1-methoxy-N-propylhexan-3-amine
SMILESCCCNC(CCC)CCOC
InChIInChI=1S/C10H23NO/c1-4-6-10(7-9-12-3)11-8-5-2/h10-11H,4-9H2,1-3H3
InChIKeyVCBCUISJGPULMR-UHFFFAOYSA-N
MW173.30 g/mol
LogP2.19
Rot. Bonds8

About 1-methoxy-N-propylhexan-3-amine

1-methoxy-N-propylhexan-3-amine (PubChem CID 61412304) has the molecular formula C10H23NO and a molecular weight of 173.30 g/mol. Its IUPAC name is 1-methoxy-N-propylhexan-3-amine.

Molecular Properties

Compound Name1-methoxy-N-propylhexan-3-amine
PubChem CID61412304
Molecular FormulaC10H23NO
Molecular Weight173.30 g/mol
Exact Mass173.18
IUPAC Name1-methoxy-N-propylhexan-3-amine
SMILESCCCNC(CCC)CCOC
InChIInChI=1S/C10H23NO/c1-4-6-10(7-9-12-3)11-8-5-2/h10-11H,4-9H2,1-3H3
InChIKeyVCBCUISJGPULMR-UHFFFAOYSA-N
XLogP2.19
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.30
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-methoxy-5-(3-methylbutoxy)-N-propylpentan-3-amine
CID 55095563
1-methoxy-N-propyldec-9-en-3-amine
CID 107008934
1-methoxy-N-propyldodecan-4-amine
CID 65091880
1-cyclopropyl-5-methoxy-N-propylpentan-2-amine
CID 65091943
1-methoxy-N-propylnon-8-en-4-amine
CID 65091822
1-(2-methoxyethoxy)-N-propyloct-7-en-3-amine
CID 102928668
1-methoxy-N-(4-methoxybutyl)pentan-2-amine
CID 104647445
1-propoxy-N-propylheptan-4-amine
CID 79568616
1-methoxy-5-(oxolan-2-yl)-N-propylpentan-3-amine
CID 65164444
3-N-propylhexane-1,3-diamine
CID 88724695
1-(2,2-difluoroethoxy)-6-methoxy-N-propylhexan-3-amine
CID 103149832
4-methoxy-N-propyl-1-pyridin-4-ylbutan-2-amine
CID 62605290

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-N-propylhexan-3-amine?
The IUPAC name of 1-methoxy-N-propylhexan-3-amine (CID 61412304) is 1-methoxy-N-propylhexan-3-amine.
What is the SMILES notation for 1-methoxy-N-propylhexan-3-amine?
The canonical SMILES for 1-methoxy-N-propylhexan-3-amine is CCCNC(CCC)CCOC.
What is the InChIKey of 1-methoxy-N-propylhexan-3-amine?
The InChIKey is VCBCUISJGPULMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO/c1-4-6-10(7-9-12-3)11-8-5-2/h10-11H,4-9H2,1-3H3.
What are the key properties of 1-methoxy-N-propylhexan-3-amine?
1-methoxy-N-propylhexan-3-amine has a molecular weight of 173.30 g/mol, XLogP of 2.19, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-N-propylhexan-3-amine is sourced from PubChem (CID 61412304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).