[1-[di(propan-2-yl)amino]cyclopentyl]methanol

C12H25NO — CID 138744856

IUPAC[1-[di(propan-2-yl)amino]cyclopentyl]methanol
SMILESCC(C)N(C(C)C)C1(CO)CCCC1
InChIInChI=1S/C12H25NO/c1-10(2)13(11(3)4)12(9-14)7-5-6-8-12/h10-11,14H,5-9H2,1-4H3
InChIKeyUFVQQPHIJMRRFH-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.41
Rot. Bonds4

About [1-[di(propan-2-yl)amino]cyclopentyl]methanol

[1-[di(propan-2-yl)amino]cyclopentyl]methanol (PubChem CID 138744856) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is [1-[di(propan-2-yl)amino]cyclopentyl]methanol.

Molecular Properties

Compound Name[1-[di(propan-2-yl)amino]cyclopentyl]methanol
PubChem CID138744856
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC Name[1-[di(propan-2-yl)amino]cyclopentyl]methanol
SMILESCC(C)N(C(C)C)C1(CO)CCCC1
InChIInChI=1S/C12H25NO/c1-10(2)13(11(3)4)12(9-14)7-5-6-8-12/h10-11,14H,5-9H2,1-4H3
InChIKeyUFVQQPHIJMRRFH-UHFFFAOYSA-N
XLogP2.41
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-[di(propan-2-yl)amino]cyclopentyl]methanol?
The IUPAC name of [1-[di(propan-2-yl)amino]cyclopentyl]methanol (CID 138744856) is [1-[di(propan-2-yl)amino]cyclopentyl]methanol.
What is the SMILES notation for [1-[di(propan-2-yl)amino]cyclopentyl]methanol?
The canonical SMILES for [1-[di(propan-2-yl)amino]cyclopentyl]methanol is CC(C)N(C(C)C)C1(CO)CCCC1.
What is the InChIKey of [1-[di(propan-2-yl)amino]cyclopentyl]methanol?
The InChIKey is UFVQQPHIJMRRFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-10(2)13(11(3)4)12(9-14)7-5-6-8-12/h10-11,14H,5-9H2,1-4H3.
What are the key properties of [1-[di(propan-2-yl)amino]cyclopentyl]methanol?
[1-[di(propan-2-yl)amino]cyclopentyl]methanol has a molecular weight of 199.34 g/mol, XLogP of 2.41, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[di(propan-2-yl)amino]cyclopentyl]methanol is sourced from PubChem (CID 138744856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).