2,2-dimethyl-5-[[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]methyl]cyclopentan-1-ol

C15H30N2O — CID 79855131

IUPAC2,2-dimethyl-5-[[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]methyl]cyclopentan-1-ol
SMILESCN1CCC(CN(C)CC2CCC(C)(C)C2O)C1
InChIInChI=1S/C15H30N2O/c1-15(2)7-5-13(14(15)18)11-17(4)10-12-6-8-16(3)9-12/h12-14,18H,5-11H2,1-4H3
InChIKeyMGGJTLVFGJXBDT-UHFFFAOYSA-N
MW254.42 g/mol
LogP1.67
Rot. Bonds4

About 2,2-dimethyl-5-[[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]methyl]cyclopentan-1-ol

2,2-dimethyl-5-[[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]methyl]cyclopentan-1-ol (PubChem CID 79855131) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 2,2-dimethyl-5-[[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name2,2-dimethyl-5-[[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]methyl]cyclopentan-1-ol
PubChem CID79855131
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name2,2-dimethyl-5-[[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]methyl]cyclopentan-1-ol
SMILESCN1CCC(CN(C)CC2CCC(C)(C)C2O)C1
InChIInChI=1S/C15H30N2O/c1-15(2)7-5-13(14(15)18)11-17(4)10-12-6-8-16(3)9-12/h12-14,18H,5-11H2,1-4H3
InChIKeyMGGJTLVFGJXBDT-UHFFFAOYSA-N
XLogP1.67
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[[cyclopropylmethyl(methyl)amino]methyl]-2,2-dimethylcyclopentan-1-ol
CID 79855050
N-methyl-1-(1-methylpiperidin-4-yl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine
CID 169319670
2,2-dimethyl-5-[[methyl(2-methylpropyl)amino]methyl]cyclopentan-1-ol
CID 79855430
5-[[2-hydroxypropyl(methyl)amino]methyl]-2,2-dimethylcyclopentan-1-ol
CID 79856126
4-[[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]methyl]cyclohexan-1-one
CID 115240224
1-[[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]methyl]cyclopropan-1-amine
CID 65460030
N-ethyl-2-[[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]methyl]cyclohexan-1-amine
CID 55170284
N-ethyl-2-[[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]methyl]cycloheptan-1-amine
CID 63274438
2,2-dimethyl-6-[[methyl(oxan-4-ylmethyl)amino]methyl]cyclohexan-1-ol
CID 79848513
2-[methyl-[[(3S)-1-methylpyrrolidin-3-yl]methyl]amino]acetic acid
CID 96639224
1-[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]propan-2-one
CID 63273547
N-methyl-1-(4-methylcyclohexyl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine
CID 176641061

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-5-[[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]methyl]cyclopentan-1-ol?
The IUPAC name of 2,2-dimethyl-5-[[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]methyl]cyclopentan-1-ol (CID 79855131) is 2,2-dimethyl-5-[[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 2,2-dimethyl-5-[[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]methyl]cyclopentan-1-ol?
The canonical SMILES for 2,2-dimethyl-5-[[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]methyl]cyclopentan-1-ol is CN1CCC(CN(C)CC2CCC(C)(C)C2O)C1.
What is the InChIKey of 2,2-dimethyl-5-[[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]methyl]cyclopentan-1-ol?
The InChIKey is MGGJTLVFGJXBDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-15(2)7-5-13(14(15)18)11-17(4)10-12-6-8-16(3)9-12/h12-14,18H,5-11H2,1-4H3.
What are the key properties of 2,2-dimethyl-5-[[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]methyl]cyclopentan-1-ol?
2,2-dimethyl-5-[[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]methyl]cyclopentan-1-ol has a molecular weight of 254.42 g/mol, XLogP of 1.67, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-5-[[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 79855131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).