1-(1-amino-2-methylpropan-2-yl)-3-methylcyclopentan-1-ol

C10H21NO — CID 79125565

IUPAC1-(1-amino-2-methylpropan-2-yl)-3-methylcyclopentan-1-ol
SMILESCC1CCC(O)(C(C)(C)CN)C1
InChIInChI=1S/C10H21NO/c1-8-4-5-10(12,6-8)9(2,3)7-11/h8,12H,4-7,11H2,1-3H3
InChIKeyGBBPOKUNXFHWEK-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.52
Rot. Bonds2

About 1-(1-amino-2-methylpropan-2-yl)-3-methylcyclopentan-1-ol

1-(1-amino-2-methylpropan-2-yl)-3-methylcyclopentan-1-ol (PubChem CID 79125565) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 1-(1-amino-2-methylpropan-2-yl)-3-methylcyclopentan-1-ol.

Molecular Properties

Compound Name1-(1-amino-2-methylpropan-2-yl)-3-methylcyclopentan-1-ol
PubChem CID79125565
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name1-(1-amino-2-methylpropan-2-yl)-3-methylcyclopentan-1-ol
SMILESCC1CCC(O)(C(C)(C)CN)C1
InChIInChI=1S/C10H21NO/c1-8-4-5-10(12,6-8)9(2,3)7-11/h8,12H,4-7,11H2,1-3H3
InChIKeyGBBPOKUNXFHWEK-UHFFFAOYSA-N
XLogP1.52
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(1-amino-2-methylpropan-2-yl)-3-methylcyclopentan-1-ol?
The IUPAC name of 1-(1-amino-2-methylpropan-2-yl)-3-methylcyclopentan-1-ol (CID 79125565) is 1-(1-amino-2-methylpropan-2-yl)-3-methylcyclopentan-1-ol.
What is the SMILES notation for 1-(1-amino-2-methylpropan-2-yl)-3-methylcyclopentan-1-ol?
The canonical SMILES for 1-(1-amino-2-methylpropan-2-yl)-3-methylcyclopentan-1-ol is CC1CCC(O)(C(C)(C)CN)C1.
What is the InChIKey of 1-(1-amino-2-methylpropan-2-yl)-3-methylcyclopentan-1-ol?
The InChIKey is GBBPOKUNXFHWEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-8-4-5-10(12,6-8)9(2,3)7-11/h8,12H,4-7,11H2,1-3H3.
What are the key properties of 1-(1-amino-2-methylpropan-2-yl)-3-methylcyclopentan-1-ol?
1-(1-amino-2-methylpropan-2-yl)-3-methylcyclopentan-1-ol has a molecular weight of 171.28 g/mol, XLogP of 1.52, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-amino-2-methylpropan-2-yl)-3-methylcyclopentan-1-ol is sourced from PubChem (CID 79125565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).