1-(4-cyclopropyloxyphenyl)-2-methylpropan-1-amine

C13H19NO — CID 114519212

IUPAC1-(4-cyclopropyloxyphenyl)-2-methylpropan-1-amine
SMILESCC(C)C(N)c1ccc(OC2CC2)cc1
InChIInChI=1S/C13H19NO/c1-9(2)13(14)10-3-5-11(6-4-10)15-12-7-8-12/h3-6,9,12-13H,7-8,14H2,1-2H3
InChIKeyRIOXOTQVYXTJDM-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.88
Rot. Bonds4

About 1-(4-cyclopropyloxyphenyl)-2-methylpropan-1-amine

1-(4-cyclopropyloxyphenyl)-2-methylpropan-1-amine (PubChem CID 114519212) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 1-(4-cyclopropyloxyphenyl)-2-methylpropan-1-amine.

Molecular Properties

Compound Name1-(4-cyclopropyloxyphenyl)-2-methylpropan-1-amine
PubChem CID114519212
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name1-(4-cyclopropyloxyphenyl)-2-methylpropan-1-amine
SMILESCC(C)C(N)c1ccc(OC2CC2)cc1
InChIInChI=1S/C13H19NO/c1-9(2)13(14)10-3-5-11(6-4-10)15-12-7-8-12/h3-6,9,12-13H,7-8,14H2,1-2H3
InChIKeyRIOXOTQVYXTJDM-UHFFFAOYSA-N
XLogP2.88
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-cyclopentyloxyphenyl)ethanamine;hydrochloride
CID 155890234
1-(4-cyclopropyloxyphenyl)-2-methoxy-2-phenylethanamine
CID 114519844
1-(4-cyclopropyloxyphenyl)-2-phenylbutan-1-amine
CID 105051483
1-cyclopentyloxy-4-propan-2-ylbenzene
CID 10442918
1-[4-(3,5-dimethylcyclohexyl)oxyphenyl]ethanamine
CID 64737275
(4-cyclopropyloxyphenyl)-(4-fluorophenyl)methanamine
CID 114519186
(1S)-1-[4-(3,5-dimethylcyclohexyl)oxyphenyl]ethanamine
CID 64734743
cycloheptyl-(4-cyclopropyloxyphenyl)methanamine
CID 114519512
(1S)-1-[4-(4-methylcyclohexyl)oxyphenyl]propan-1-amine
CID 78999289
4-(1-amino-2-methylpropyl)aniline
CID 55283645
(1S)-1-[4-(3-ethylcyclohexyl)oxyphenyl]ethanamine
CID 78967085
(1R)-1-[4-(3-methoxycyclohexyl)oxyphenyl]ethanamine
CID 78958674

Frequently Asked Questions

What is the IUPAC name of 1-(4-cyclopropyloxyphenyl)-2-methylpropan-1-amine?
The IUPAC name of 1-(4-cyclopropyloxyphenyl)-2-methylpropan-1-amine (CID 114519212) is 1-(4-cyclopropyloxyphenyl)-2-methylpropan-1-amine.
What is the SMILES notation for 1-(4-cyclopropyloxyphenyl)-2-methylpropan-1-amine?
The canonical SMILES for 1-(4-cyclopropyloxyphenyl)-2-methylpropan-1-amine is CC(C)C(N)c1ccc(OC2CC2)cc1.
What is the InChIKey of 1-(4-cyclopropyloxyphenyl)-2-methylpropan-1-amine?
The InChIKey is RIOXOTQVYXTJDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-9(2)13(14)10-3-5-11(6-4-10)15-12-7-8-12/h3-6,9,12-13H,7-8,14H2,1-2H3.
What are the key properties of 1-(4-cyclopropyloxyphenyl)-2-methylpropan-1-amine?
1-(4-cyclopropyloxyphenyl)-2-methylpropan-1-amine has a molecular weight of 205.30 g/mol, XLogP of 2.88, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-cyclopropyloxyphenyl)-2-methylpropan-1-amine is sourced from PubChem (CID 114519212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).