[(1R)-2-(4-methoxyphenyl)-2-propan-2-ylcyclopropyl]methanamine

C14H21NO — CID 105474852

IUPAC[(1R)-2-(4-methoxyphenyl)-2-propan-2-ylcyclopropyl]methanamine
SMILESCOc1ccc(C2(C(C)C)C[C@H]2CN)cc1
InChIInChI=1S/C14H21NO/c1-10(2)14(8-12(14)9-15)11-4-6-13(16-3)7-5-11/h4-7,10,12H,8-9,15H2,1-3H3/t12-,14?/m0/s1
InChIKeyFSKNWSDXWFPWQE-NBFOIZRFSA-N
MW219.33 g/mol
LogP2.57
Rot. Bonds4

About [(1R)-2-(4-methoxyphenyl)-2-propan-2-ylcyclopropyl]methanamine

[(1R)-2-(4-methoxyphenyl)-2-propan-2-ylcyclopropyl]methanamine (PubChem CID 105474852) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is [(1R)-2-(4-methoxyphenyl)-2-propan-2-ylcyclopropyl]methanamine.

Molecular Properties

Compound Name[(1R)-2-(4-methoxyphenyl)-2-propan-2-ylcyclopropyl]methanamine
PubChem CID105474852
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name[(1R)-2-(4-methoxyphenyl)-2-propan-2-ylcyclopropyl]methanamine
SMILESCOc1ccc(C2(C(C)C)C[C@H]2CN)cc1
InChIInChI=1S/C14H21NO/c1-10(2)14(8-12(14)9-15)11-4-6-13(16-3)7-5-11/h4-7,10,12H,8-9,15H2,1-3H3/t12-,14?/m0/s1
InChIKeyFSKNWSDXWFPWQE-NBFOIZRFSA-N
XLogP2.57
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1R)-2-ethyl-2-(4-methoxyphenyl)cyclopropan-1-amine
CID 105445465
3-(4-methoxyphenyl)-3-methylcyclopentan-1-amine
CID 116538662
(6-methoxyspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-yl)methanamine
CID 79247847
1-methoxy-4-(1,3,4-trimethylcyclopent-3-en-1-yl)benzene
CID 10965945
2-ethyl-1-(4-methoxyphenyl)cyclopropan-1-ol
CID 79332791
1-(4-methoxyphenyl)ethane-1,2-diamine;hydrochloride
CID 70626122
N-[[2-ethyl-2-(4-methoxyphenyl)cyclopropyl]methyl]-2-methylpropan-1-amine
CID 62714780
1-(4-methoxyphenyl)-3,5-dimethylcyclohexan-1-amine
CID 64751441
2-[(2R,4S,5S)-4-(4-methoxyphenyl)-1,2,5-trimethylpiperidin-4-yl]ethanamine
CID 7198410
1-methoxy-4-[1,2,2-tris(4-methoxyphenyl)cyclopropyl]benzene
CID 12846256
2-[(4-methoxyphenyl)methyl]-2-methylcyclopropan-1-amine;hydrochloride
CID 71756717
1-methoxy-4-[1-(4-methoxyphenyl)-2-methylidenecyclopropyl]benzene
CID 13355231

Frequently Asked Questions

What is the IUPAC name of [(1R)-2-(4-methoxyphenyl)-2-propan-2-ylcyclopropyl]methanamine?
The IUPAC name of [(1R)-2-(4-methoxyphenyl)-2-propan-2-ylcyclopropyl]methanamine (CID 105474852) is [(1R)-2-(4-methoxyphenyl)-2-propan-2-ylcyclopropyl]methanamine.
What is the SMILES notation for [(1R)-2-(4-methoxyphenyl)-2-propan-2-ylcyclopropyl]methanamine?
The canonical SMILES for [(1R)-2-(4-methoxyphenyl)-2-propan-2-ylcyclopropyl]methanamine is COc1ccc(C2(C(C)C)C[C@H]2CN)cc1.
What is the InChIKey of [(1R)-2-(4-methoxyphenyl)-2-propan-2-ylcyclopropyl]methanamine?
The InChIKey is FSKNWSDXWFPWQE-NBFOIZRFSA-N. The full InChI is InChI=1S/C14H21NO/c1-10(2)14(8-12(14)9-15)11-4-6-13(16-3)7-5-11/h4-7,10,12H,8-9,15H2,1-3H3/t12-,14?/m0/s1.
What are the key properties of [(1R)-2-(4-methoxyphenyl)-2-propan-2-ylcyclopropyl]methanamine?
[(1R)-2-(4-methoxyphenyl)-2-propan-2-ylcyclopropyl]methanamine has a molecular weight of 219.33 g/mol, XLogP of 2.57, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R)-2-(4-methoxyphenyl)-2-propan-2-ylcyclopropyl]methanamine is sourced from PubChem (CID 105474852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).