[1-[[2-methylpropyl(pentan-3-yl)amino]methyl]cyclopentyl]methanol

C16H33NO — CID 79490750

IUPAC[1-[[2-methylpropyl(pentan-3-yl)amino]methyl]cyclopentyl]methanol
SMILESCCC(CC)N(CC(C)C)CC1(CO)CCCC1
InChIInChI=1S/C16H33NO/c1-5-15(6-2)17(11-14(3)4)12-16(13-18)9-7-8-10-16/h14-15,18H,5-13H2,1-4H3
InChIKeyVCFSUXCUOCNAFT-UHFFFAOYSA-N
MW255.45 g/mol
LogP3.69
Rot. Bonds8

About [1-[[2-methylpropyl(pentan-3-yl)amino]methyl]cyclopentyl]methanol

[1-[[2-methylpropyl(pentan-3-yl)amino]methyl]cyclopentyl]methanol (PubChem CID 79490750) has the molecular formula C16H33NO and a molecular weight of 255.45 g/mol. Its IUPAC name is [1-[[2-methylpropyl(pentan-3-yl)amino]methyl]cyclopentyl]methanol.

Molecular Properties

Compound Name[1-[[2-methylpropyl(pentan-3-yl)amino]methyl]cyclopentyl]methanol
PubChem CID79490750
Molecular FormulaC16H33NO
Molecular Weight255.45 g/mol
Exact Mass255.26
IUPAC Name[1-[[2-methylpropyl(pentan-3-yl)amino]methyl]cyclopentyl]methanol
SMILESCCC(CC)N(CC(C)C)CC1(CO)CCCC1
InChIInChI=1S/C16H33NO/c1-5-15(6-2)17(11-14(3)4)12-16(13-18)9-7-8-10-16/h14-15,18H,5-13H2,1-4H3
InChIKeyVCFSUXCUOCNAFT-UHFFFAOYSA-N
XLogP3.69
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.45
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[1-[[bis(2-methylpropyl)amino]methyl]cyclopentyl]methanol
CID 62270231
N-[[1-(bromomethyl)cyclopropyl]methyl]-N-(2-methylpropyl)pentan-3-amine
CID 79483320
2-[1-[[2-methylpropyl(pentan-3-yl)amino]methyl]cyclopropyl]ethanethioamide
CID 79484038
N-[[3-(aminomethyl)oxolan-3-yl]methyl]-N-(2-methylpropyl)pentan-3-amine
CID 79489290
3-[[2-methylpropyl(pentan-3-yl)amino]methyl]oxane-3-carboxylic acid
CID 79489776
[1-[[cyclopropyl(2-methylpropyl)amino]methyl]cyclopentyl]methanol
CID 62266509
N-[2-[1-(aminomethyl)cyclohexyl]ethyl]-N-(2-methylpropyl)pentan-3-amine
CID 104678976
[1-[[methyl(4-methylpentan-2-yl)amino]methyl]cyclopentyl]methanol
CID 62266180
N,N-bis(2-methylpropyl)pentan-3-amine
CID 20735455
[1-[[methyl(3-methylbutan-2-yl)amino]methyl]cyclohexyl]methanol
CID 62271498
1-[[2-methylpropyl(propan-2-yl)amino]methyl]cyclopentan-1-ol
CID 65212512
1-[[2-hydroxyethyl(pentan-3-yl)amino]methyl]cyclopentan-1-ol
CID 65212496

Frequently Asked Questions

What is the IUPAC name of [1-[[2-methylpropyl(pentan-3-yl)amino]methyl]cyclopentyl]methanol?
The IUPAC name of [1-[[2-methylpropyl(pentan-3-yl)amino]methyl]cyclopentyl]methanol (CID 79490750) is [1-[[2-methylpropyl(pentan-3-yl)amino]methyl]cyclopentyl]methanol.
What is the SMILES notation for [1-[[2-methylpropyl(pentan-3-yl)amino]methyl]cyclopentyl]methanol?
The canonical SMILES for [1-[[2-methylpropyl(pentan-3-yl)amino]methyl]cyclopentyl]methanol is CCC(CC)N(CC(C)C)CC1(CO)CCCC1.
What is the InChIKey of [1-[[2-methylpropyl(pentan-3-yl)amino]methyl]cyclopentyl]methanol?
The InChIKey is VCFSUXCUOCNAFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33NO/c1-5-15(6-2)17(11-14(3)4)12-16(13-18)9-7-8-10-16/h14-15,18H,5-13H2,1-4H3.
What are the key properties of [1-[[2-methylpropyl(pentan-3-yl)amino]methyl]cyclopentyl]methanol?
[1-[[2-methylpropyl(pentan-3-yl)amino]methyl]cyclopentyl]methanol has a molecular weight of 255.45 g/mol, XLogP of 3.69, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[2-methylpropyl(pentan-3-yl)amino]methyl]cyclopentyl]methanol is sourced from PubChem (CID 79490750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).