3-[[(3-methylphenyl)methylamino]methyl]cyclopentan-1-ol

C14H21NO — CID 103270659

IUPAC3-[[(3-methylphenyl)methylamino]methyl]cyclopentan-1-ol
SMILESCc1cccc(CNCC2CCC(O)C2)c1
InChIInChI=1S/C14H21NO/c1-11-3-2-4-12(7-11)9-15-10-13-5-6-14(16)8-13/h2-4,7,13-16H,5-6,8-10H2,1H3
InChIKeyXNMDCDJAEFEJKX-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.25
Rot. Bonds4

About 3-[[(3-methylphenyl)methylamino]methyl]cyclopentan-1-ol

3-[[(3-methylphenyl)methylamino]methyl]cyclopentan-1-ol (PubChem CID 103270659) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 3-[[(3-methylphenyl)methylamino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name3-[[(3-methylphenyl)methylamino]methyl]cyclopentan-1-ol
PubChem CID103270659
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name3-[[(3-methylphenyl)methylamino]methyl]cyclopentan-1-ol
SMILESCc1cccc(CNCC2CCC(O)C2)c1
InChIInChI=1S/C14H21NO/c1-11-3-2-4-12(7-11)9-15-10-13-5-6-14(16)8-13/h2-4,7,13-16H,5-6,8-10H2,1H3
InChIKeyXNMDCDJAEFEJKX-UHFFFAOYSA-N
XLogP2.25
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-[[(3,5-dimethylphenyl)methylamino]methyl]cyclopentan-1-ol
CID 103270774
3-[[[3-(methoxymethyl)phenyl]methylamino]methyl]cyclopentan-1-ol
CID 103270675
3-[[4-(3-methylphenyl)butan-2-ylamino]methyl]cyclopentan-1-ol
CID 103271353
3-[[(3-hydroxycyclopentyl)methylamino]methyl]benzamide
CID 103270759
N'-hydroxy-3-[[(3-hydroxycyclopentyl)methylamino]methyl]benzenecarboximidamide
CID 106136286
3-[[(3,5-dimethylphenyl)methylamino]methyl]cyclohexan-1-ol
CID 103699898
3-[[(6-methoxynaphthalen-2-yl)methylamino]methyl]cyclopentan-1-ol
CID 103270839
3-[[(2,3-dimethylphenyl)methylamino]methyl]cyclopentan-1-ol
CID 103270925
3-[[(4-fluorophenyl)methylamino]methyl]cyclopentan-1-ol
CID 103270748
2-(cyclopropylmethylamino)-N-[(3-methylphenyl)methyl]acetamide
CID 60915187
3-[[(3-hydroxycyclohexyl)methylamino]methyl]benzamide
CID 103699975
1-(5-methyloxolan-2-yl)-N-[(3-methylphenyl)methyl]methanamine
CID 82834330

Frequently Asked Questions

What is the IUPAC name of 3-[[(3-methylphenyl)methylamino]methyl]cyclopentan-1-ol?
The IUPAC name of 3-[[(3-methylphenyl)methylamino]methyl]cyclopentan-1-ol (CID 103270659) is 3-[[(3-methylphenyl)methylamino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 3-[[(3-methylphenyl)methylamino]methyl]cyclopentan-1-ol?
The canonical SMILES for 3-[[(3-methylphenyl)methylamino]methyl]cyclopentan-1-ol is Cc1cccc(CNCC2CCC(O)C2)c1.
What is the InChIKey of 3-[[(3-methylphenyl)methylamino]methyl]cyclopentan-1-ol?
The InChIKey is XNMDCDJAEFEJKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-11-3-2-4-12(7-11)9-15-10-13-5-6-14(16)8-13/h2-4,7,13-16H,5-6,8-10H2,1H3.
What are the key properties of 3-[[(3-methylphenyl)methylamino]methyl]cyclopentan-1-ol?
3-[[(3-methylphenyl)methylamino]methyl]cyclopentan-1-ol has a molecular weight of 219.33 g/mol, XLogP of 2.25, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[(3-methylphenyl)methylamino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 103270659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).