[3-[(R)-amino(cyclopropyl)methyl]-4-methylphenyl]methanol

C12H17NO — CID 130665283

IUPAC[3-[(R)-amino(cyclopropyl)methyl]-4-methylphenyl]methanol
SMILESCc1ccc(CO)cc1[C@H](N)C1CC1
InChIInChI=1S/C12H17NO/c1-8-2-3-9(7-14)6-11(8)12(13)10-4-5-10/h2-3,6,10,12,14H,4-5,7,13H2,1H3/t12-/m1/s1
InChIKeyLRQMHSJPHDXQIJ-GFCCVEGCSA-N
MW191.27 g/mol
LogP1.90
Rot. Bonds3

About [3-[(R)-amino(cyclopropyl)methyl]-4-methylphenyl]methanol

[3-[(R)-amino(cyclopropyl)methyl]-4-methylphenyl]methanol (PubChem CID 130665283) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is [3-[(R)-amino(cyclopropyl)methyl]-4-methylphenyl]methanol.

Molecular Properties

Compound Name[3-[(R)-amino(cyclopropyl)methyl]-4-methylphenyl]methanol
PubChem CID130665283
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC Name[3-[(R)-amino(cyclopropyl)methyl]-4-methylphenyl]methanol
SMILESCc1ccc(CO)cc1[C@H](N)C1CC1
InChIInChI=1S/C12H17NO/c1-8-2-3-9(7-14)6-11(8)12(13)10-4-5-10/h2-3,6,10,12,14H,4-5,7,13H2,1H3/t12-/m1/s1
InChIKeyLRQMHSJPHDXQIJ-GFCCVEGCSA-N
XLogP1.90
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(4-methyl-3-propan-2-ylphenyl)methanol
CID 20871908
[3-[(1S)-1-aminopropyl]-4-methylphenyl]methanol
CID 130674225
[4-[(R)-amino(cyclopropyl)methyl]phenyl]methanol
CID 130727327
(5-chloro-2-methylphenyl)-(4-ethylcyclohexyl)methanamine
CID 104990915
(5-bromo-2-methylphenyl)-(4-methylcyclohexyl)methanamine
CID 104988213
4-[amino-(5-bromo-2-methylphenyl)methyl]cyclohexan-1-amine
CID 116937185
[2-[(R)-amino(cyclopropyl)methyl]-4-pyridinyl]methanol
CID 55277194
(5-tert-butyl-2-methylphenyl)-cyclobutylmethanamine
CID 82289393
(R)-(5-bromo-2-methylphenyl)-cyclopentylmethanamine;hydrochloride
CID 171203860
(2,5-dimethylphenyl)-(3-ethylcyclopentyl)methanamine
CID 65410620
(2,5-dimethylphenyl)-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanamine
CID 112680940
[3-methyl-4-(4-propan-2-ylpiperidin-1-yl)phenyl]methanol
CID 103498515

Frequently Asked Questions

What is the IUPAC name of [3-[(R)-amino(cyclopropyl)methyl]-4-methylphenyl]methanol?
The IUPAC name of [3-[(R)-amino(cyclopropyl)methyl]-4-methylphenyl]methanol (CID 130665283) is [3-[(R)-amino(cyclopropyl)methyl]-4-methylphenyl]methanol.
What is the SMILES notation for [3-[(R)-amino(cyclopropyl)methyl]-4-methylphenyl]methanol?
The canonical SMILES for [3-[(R)-amino(cyclopropyl)methyl]-4-methylphenyl]methanol is Cc1ccc(CO)cc1[C@H](N)C1CC1.
What is the InChIKey of [3-[(R)-amino(cyclopropyl)methyl]-4-methylphenyl]methanol?
The InChIKey is LRQMHSJPHDXQIJ-GFCCVEGCSA-N. The full InChI is InChI=1S/C12H17NO/c1-8-2-3-9(7-14)6-11(8)12(13)10-4-5-10/h2-3,6,10,12,14H,4-5,7,13H2,1H3/t12-/m1/s1.
What are the key properties of [3-[(R)-amino(cyclopropyl)methyl]-4-methylphenyl]methanol?
[3-[(R)-amino(cyclopropyl)methyl]-4-methylphenyl]methanol has a molecular weight of 191.27 g/mol, XLogP of 1.90, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(R)-amino(cyclopropyl)methyl]-4-methylphenyl]methanol is sourced from PubChem (CID 130665283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).