(4-cyclopropyloxyphenyl)-(4-propylcyclohexyl)methanamine

C19H29NO — CID 114519515

IUPAC(4-cyclopropyloxyphenyl)-(4-propylcyclohexyl)methanamine
SMILESCCCC1CCC(C(N)c2ccc(OC3CC3)cc2)CC1
InChIInChI=1S/C19H29NO/c1-2-3-14-4-6-15(7-5-14)19(20)16-8-10-17(11-9-16)21-18-12-13-18/h8-11,14-15,18-19H,2-7,12-13,20H2,1H3
InChIKeyXSPRJBFVQWMCDH-UHFFFAOYSA-N
MW287.45 g/mol
LogP4.83
Rot. Bonds6

About (4-cyclopropyloxyphenyl)-(4-propylcyclohexyl)methanamine

(4-cyclopropyloxyphenyl)-(4-propylcyclohexyl)methanamine (PubChem CID 114519515) has the molecular formula C19H29NO and a molecular weight of 287.45 g/mol. Its IUPAC name is (4-cyclopropyloxyphenyl)-(4-propylcyclohexyl)methanamine.

Molecular Properties

Compound Name(4-cyclopropyloxyphenyl)-(4-propylcyclohexyl)methanamine
PubChem CID114519515
Molecular FormulaC19H29NO
Molecular Weight287.45 g/mol
Exact Mass287.22
IUPAC Name(4-cyclopropyloxyphenyl)-(4-propylcyclohexyl)methanamine
SMILESCCCC1CCC(C(N)c2ccc(OC3CC3)cc2)CC1
InChIInChI=1S/C19H29NO/c1-2-3-14-4-6-15(7-5-14)19(20)16-8-10-17(11-9-16)21-18-12-13-18/h8-11,14-15,18-19H,2-7,12-13,20H2,1H3
InChIKeyXSPRJBFVQWMCDH-UHFFFAOYSA-N
XLogP4.83
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.45
LogP ≤ 54.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4-ethoxyphenyl)-(4-propylcyclohexyl)methanamine
CID 65422984
cycloheptyl-(4-cyclopropyloxyphenyl)methanamine
CID 114519512
(6-methyl-3-pyridinyl)-(4-propylcyclohexyl)methanamine
CID 65424529
(4-ethylcyclohexyl)-(4-propoxyphenyl)methanamine
CID 65393938
[(4-cyclopropyloxyphenyl)-(4-ethylcyclohexyl)methyl]hydrazine
CID 105231410
(1S)-1-[4-(4-methylcyclohexyl)oxyphenyl]propan-1-amine
CID 78999289
ethane;1-(4-ethylcyclohexyl)oxy-4-propan-2-ylbenzene
CID 176986547
1-bromo-4-(3-propylcyclopentyl)oxybenzene
CID 141355711
4-[amino-(4-ethoxyphenyl)methyl]-N-methylcyclohexan-1-amine
CID 116937243
1-ethoxy-4-[hydroperoxy-(4-propylcyclohexyl)methyl]benzene
CID 58132107
1-methyl-4-(4-pentylcyclohexyl)oxybenzene
CID 20667925
2-cyclohexyl-1-(4-cyclopropyloxyphenyl)ethanamine
CID 105051379

Frequently Asked Questions

What is the IUPAC name of (4-cyclopropyloxyphenyl)-(4-propylcyclohexyl)methanamine?
The IUPAC name of (4-cyclopropyloxyphenyl)-(4-propylcyclohexyl)methanamine (CID 114519515) is (4-cyclopropyloxyphenyl)-(4-propylcyclohexyl)methanamine.
What is the SMILES notation for (4-cyclopropyloxyphenyl)-(4-propylcyclohexyl)methanamine?
The canonical SMILES for (4-cyclopropyloxyphenyl)-(4-propylcyclohexyl)methanamine is CCCC1CCC(C(N)c2ccc(OC3CC3)cc2)CC1.
What is the InChIKey of (4-cyclopropyloxyphenyl)-(4-propylcyclohexyl)methanamine?
The InChIKey is XSPRJBFVQWMCDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29NO/c1-2-3-14-4-6-15(7-5-14)19(20)16-8-10-17(11-9-16)21-18-12-13-18/h8-11,14-15,18-19H,2-7,12-13,20H2,1H3.
What are the key properties of (4-cyclopropyloxyphenyl)-(4-propylcyclohexyl)methanamine?
(4-cyclopropyloxyphenyl)-(4-propylcyclohexyl)methanamine has a molecular weight of 287.45 g/mol, XLogP of 4.83, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-cyclopropyloxyphenyl)-(4-propylcyclohexyl)methanamine is sourced from PubChem (CID 114519515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).