4-(1-methoxypropan-2-ylamino)cyclohexan-1-ol

C10H21NO2 — CID 62535244

IUPAC4-(1-methoxypropan-2-ylamino)cyclohexan-1-ol
SMILESCOCC(C)NC1CCC(O)CC1
InChIInChI=1S/C10H21NO2/c1-8(7-13-2)11-9-3-5-10(12)6-4-9/h8-12H,3-7H2,1-2H3
InChIKeyMIULQZFEGXESRF-UHFFFAOYSA-N
MW187.28 g/mol
LogP0.91
Rot. Bonds4

About 4-(1-methoxypropan-2-ylamino)cyclohexan-1-ol

4-(1-methoxypropan-2-ylamino)cyclohexan-1-ol (PubChem CID 62535244) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 4-(1-methoxypropan-2-ylamino)cyclohexan-1-ol.

Molecular Properties

Compound Name4-(1-methoxypropan-2-ylamino)cyclohexan-1-ol
PubChem CID62535244
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name4-(1-methoxypropan-2-ylamino)cyclohexan-1-ol
SMILESCOCC(C)NC1CCC(O)CC1
InChIInChI=1S/C10H21NO2/c1-8(7-13-2)11-9-3-5-10(12)6-4-9/h8-12H,3-7H2,1-2H3
InChIKeyMIULQZFEGXESRF-UHFFFAOYSA-N
XLogP0.91
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(1-methoxypropan-2-ylamino)cyclohexan-1-ol?
The IUPAC name of 4-(1-methoxypropan-2-ylamino)cyclohexan-1-ol (CID 62535244) is 4-(1-methoxypropan-2-ylamino)cyclohexan-1-ol.
What is the SMILES notation for 4-(1-methoxypropan-2-ylamino)cyclohexan-1-ol?
The canonical SMILES for 4-(1-methoxypropan-2-ylamino)cyclohexan-1-ol is COCC(C)NC1CCC(O)CC1.
What is the InChIKey of 4-(1-methoxypropan-2-ylamino)cyclohexan-1-ol?
The InChIKey is MIULQZFEGXESRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-8(7-13-2)11-9-3-5-10(12)6-4-9/h8-12H,3-7H2,1-2H3.
What are the key properties of 4-(1-methoxypropan-2-ylamino)cyclohexan-1-ol?
4-(1-methoxypropan-2-ylamino)cyclohexan-1-ol has a molecular weight of 187.28 g/mol, XLogP of 0.91, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-methoxypropan-2-ylamino)cyclohexan-1-ol is sourced from PubChem (CID 62535244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).