4-[amino-(4-methylphenyl)methyl]cyclohexan-1-ol

C14H21NO — CID 116941804

IUPAC4-[amino-(4-methylphenyl)methyl]cyclohexan-1-ol
SMILESCc1ccc(C(N)C2CCC(O)CC2)cc1
InChIInChI=1S/C14H21NO/c1-10-2-4-11(5-3-10)14(15)12-6-8-13(16)9-7-12/h2-5,12-14,16H,6-9,15H2,1H3
InChIKeyCTOJYBWQNWBCMU-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.55
Rot. Bonds2

About 4-[amino-(4-methylphenyl)methyl]cyclohexan-1-ol

4-[amino-(4-methylphenyl)methyl]cyclohexan-1-ol (PubChem CID 116941804) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 4-[amino-(4-methylphenyl)methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name4-[amino-(4-methylphenyl)methyl]cyclohexan-1-ol
PubChem CID116941804
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name4-[amino-(4-methylphenyl)methyl]cyclohexan-1-ol
SMILESCc1ccc(C(N)C2CCC(O)CC2)cc1
InChIInChI=1S/C14H21NO/c1-10-2-4-11(5-3-10)14(15)12-6-8-13(16)9-7-12/h2-5,12-14,16H,6-9,15H2,1H3
InChIKeyCTOJYBWQNWBCMU-UHFFFAOYSA-N
XLogP2.55
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(4-methylphenyl)-(4-propan-2-ylcyclohexyl)methanamine
CID 65424560
(S)-(4-methylphenyl)-(oxan-4-yl)methanamine
CID 94891785
4-[amino(naphthalen-2-yl)methyl]cyclohexan-1-ol
CID 116941899
4-[amino-(2-methyl-1,3-benzoxazol-5-yl)methyl]cyclohexan-1-ol
CID 116941871
(4-methylphenyl)-(oxolan-3-yl)methanamine
CID 61271786
cyclopropyl-[4-(4-methylphenyl)phenyl]methanol
CID 175668827
(5-methyloxolan-3-yl)-(4-methylphenyl)methanamine
CID 114824909
[4-[(R)-amino(cyclopropyl)methyl]phenyl]methanol
CID 130727327
4-[amino-(3-methylthiophen-2-yl)methyl]cyclohexan-1-ol
CID 116941904
4-[(S)-amino(cyclobutyl)methyl]phenol
CID 130741168
4-[(R)-amino(cyclobutyl)methyl]phenol
CID 130780811
[4-[(R)-amino(cyclopropyl)methyl]phenyl] acetate
CID 171209811

Frequently Asked Questions

What is the IUPAC name of 4-[amino-(4-methylphenyl)methyl]cyclohexan-1-ol?
The IUPAC name of 4-[amino-(4-methylphenyl)methyl]cyclohexan-1-ol (CID 116941804) is 4-[amino-(4-methylphenyl)methyl]cyclohexan-1-ol.
What is the SMILES notation for 4-[amino-(4-methylphenyl)methyl]cyclohexan-1-ol?
The canonical SMILES for 4-[amino-(4-methylphenyl)methyl]cyclohexan-1-ol is Cc1ccc(C(N)C2CCC(O)CC2)cc1.
What is the InChIKey of 4-[amino-(4-methylphenyl)methyl]cyclohexan-1-ol?
The InChIKey is CTOJYBWQNWBCMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-10-2-4-11(5-3-10)14(15)12-6-8-13(16)9-7-12/h2-5,12-14,16H,6-9,15H2,1H3.
What are the key properties of 4-[amino-(4-methylphenyl)methyl]cyclohexan-1-ol?
4-[amino-(4-methylphenyl)methyl]cyclohexan-1-ol has a molecular weight of 219.33 g/mol, XLogP of 2.55, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[amino-(4-methylphenyl)methyl]cyclohexan-1-ol is sourced from PubChem (CID 116941804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).