1-cyclohexyl-3-methoxypropan-1-amine

C10H21NO — CID 61412919

IUPAC1-cyclohexyl-3-methoxypropan-1-amine
SMILESCOCCC(N)C1CCCCC1
InChIInChI=1S/C10H21NO/c1-12-8-7-10(11)9-5-3-2-4-6-9/h9-10H,2-8,11H2,1H3
InChIKeyLEBHFLWUHNHKHD-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.93
Rot. Bonds4

About 1-cyclohexyl-3-methoxypropan-1-amine

1-cyclohexyl-3-methoxypropan-1-amine (PubChem CID 61412919) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 1-cyclohexyl-3-methoxypropan-1-amine.

Molecular Properties

Compound Name1-cyclohexyl-3-methoxypropan-1-amine
PubChem CID61412919
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name1-cyclohexyl-3-methoxypropan-1-amine
SMILESCOCCC(N)C1CCCCC1
InChIInChI=1S/C10H21NO/c1-12-8-7-10(11)9-5-3-2-4-6-9/h9-10H,2-8,11H2,1H3
InChIKeyLEBHFLWUHNHKHD-UHFFFAOYSA-N
XLogP1.93
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-3-methoxypropan-1-amine?
The IUPAC name of 1-cyclohexyl-3-methoxypropan-1-amine (CID 61412919) is 1-cyclohexyl-3-methoxypropan-1-amine.
What is the SMILES notation for 1-cyclohexyl-3-methoxypropan-1-amine?
The canonical SMILES for 1-cyclohexyl-3-methoxypropan-1-amine is COCCC(N)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-3-methoxypropan-1-amine?
The InChIKey is LEBHFLWUHNHKHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-12-8-7-10(11)9-5-3-2-4-6-9/h9-10H,2-8,11H2,1H3.
What are the key properties of 1-cyclohexyl-3-methoxypropan-1-amine?
1-cyclohexyl-3-methoxypropan-1-amine has a molecular weight of 171.28 g/mol, XLogP of 1.93, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-3-methoxypropan-1-amine is sourced from PubChem (CID 61412919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).