3-cyclohexyloxy-N-(dicyclopropylmethyl)propan-1-amine

C16H29NO — CID 43362870

IUPAC3-cyclohexyloxy-N-(dicyclopropylmethyl)propan-1-amine
SMILESC1CCC(OCCCNC(C2CC2)C2CC2)CC1
InChIInChI=1S/C16H29NO/c1-2-5-15(6-3-1)18-12-4-11-17-16(13-7-8-13)14-9-10-14/h13-17H,1-12H2
InChIKeyJSXVQDJMGNWLPR-UHFFFAOYSA-N
MW251.41 g/mol
LogP3.50
Rot. Bonds8

About 3-cyclohexyloxy-N-(dicyclopropylmethyl)propan-1-amine

3-cyclohexyloxy-N-(dicyclopropylmethyl)propan-1-amine (PubChem CID 43362870) has the molecular formula C16H29NO and a molecular weight of 251.41 g/mol. Its IUPAC name is 3-cyclohexyloxy-N-(dicyclopropylmethyl)propan-1-amine.

Molecular Properties

Compound Name3-cyclohexyloxy-N-(dicyclopropylmethyl)propan-1-amine
PubChem CID43362870
Molecular FormulaC16H29NO
Molecular Weight251.41 g/mol
Exact Mass251.22
IUPAC Name3-cyclohexyloxy-N-(dicyclopropylmethyl)propan-1-amine
SMILESC1CCC(OCCCNC(C2CC2)C2CC2)CC1
InChIInChI=1S/C16H29NO/c1-2-5-15(6-3-1)18-12-4-11-17-16(13-7-8-13)14-9-10-14/h13-17H,1-12H2
InChIKeyJSXVQDJMGNWLPR-UHFFFAOYSA-N
XLogP3.50
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.41
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

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CID 115707843
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CID 125443596
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N-(3-cycloheptyloxypropyl)cyclohexanamine
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N-(3-cyclohexyloxypropyl)cyclopentanamine
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3-cyclopentyloxy-N-methylpropan-1-amine
CID 62444438
N-(3-cyclohexyloxypropyl)thian-4-amine
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3-cyclohexyloxy-N-(1-phenylethyl)propan-1-amine
CID 43079659
N-(3-cyclohexyloxypropyl)-1-pyrrolidin-2-ylpropan-2-amine
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Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyloxy-N-(dicyclopropylmethyl)propan-1-amine?
The IUPAC name of 3-cyclohexyloxy-N-(dicyclopropylmethyl)propan-1-amine (CID 43362870) is 3-cyclohexyloxy-N-(dicyclopropylmethyl)propan-1-amine.
What is the SMILES notation for 3-cyclohexyloxy-N-(dicyclopropylmethyl)propan-1-amine?
The canonical SMILES for 3-cyclohexyloxy-N-(dicyclopropylmethyl)propan-1-amine is C1CCC(OCCCNC(C2CC2)C2CC2)CC1.
What is the InChIKey of 3-cyclohexyloxy-N-(dicyclopropylmethyl)propan-1-amine?
The InChIKey is JSXVQDJMGNWLPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29NO/c1-2-5-15(6-3-1)18-12-4-11-17-16(13-7-8-13)14-9-10-14/h13-17H,1-12H2.
What are the key properties of 3-cyclohexyloxy-N-(dicyclopropylmethyl)propan-1-amine?
3-cyclohexyloxy-N-(dicyclopropylmethyl)propan-1-amine has a molecular weight of 251.41 g/mol, XLogP of 3.50, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyloxy-N-(dicyclopropylmethyl)propan-1-amine is sourced from PubChem (CID 43362870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).