3-(1-methylpyrazol-4-yl)-1-(1-morpholin-4-ylcyclopentyl)propan-1-ol

C16H27N3O2 — CID 103008326

IUPAC3-(1-methylpyrazol-4-yl)-1-(1-morpholin-4-ylcyclopentyl)propan-1-ol
SMILESCn1cc(CCC(O)C2(N3CCOCC3)CCCC2)cn1
InChIInChI=1S/C16H27N3O2/c1-18-13-14(12-17-18)4-5-15(20)16(6-2-3-7-16)19-8-10-21-11-9-19/h12-13,15,20H,2-11H2,1H3
InChIKeyWWNAYJKUHWZXST-UHFFFAOYSA-N
MW293.41 g/mol
LogP1.36
Rot. Bonds5

About 3-(1-methylpyrazol-4-yl)-1-(1-morpholin-4-ylcyclopentyl)propan-1-ol

3-(1-methylpyrazol-4-yl)-1-(1-morpholin-4-ylcyclopentyl)propan-1-ol (PubChem CID 103008326) has the molecular formula C16H27N3O2 and a molecular weight of 293.41 g/mol. Its IUPAC name is 3-(1-methylpyrazol-4-yl)-1-(1-morpholin-4-ylcyclopentyl)propan-1-ol.

Molecular Properties

Compound Name3-(1-methylpyrazol-4-yl)-1-(1-morpholin-4-ylcyclopentyl)propan-1-ol
PubChem CID103008326
Molecular FormulaC16H27N3O2
Molecular Weight293.41 g/mol
Exact Mass293.21
IUPAC Name3-(1-methylpyrazol-4-yl)-1-(1-morpholin-4-ylcyclopentyl)propan-1-ol
SMILESCn1cc(CCC(O)C2(N3CCOCC3)CCCC2)cn1
InChIInChI=1S/C16H27N3O2/c1-18-13-14(12-17-18)4-5-15(20)16(6-2-3-7-16)19-8-10-21-11-9-19/h12-13,15,20H,2-11H2,1H3
InChIKeyWWNAYJKUHWZXST-UHFFFAOYSA-N
XLogP1.36
TPSA50.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(1-methylcyclopentyl)-3-(1-methylpyrazol-4-yl)propan-1-ol
CID 103027896
1-(1-ethoxycyclohexyl)-3-(1-methylpyrazol-4-yl)propan-1-ol
CID 103008601
1-(1-morpholin-4-ylcyclopentyl)propan-1-ol
CID 79060024
1-(1-morpholin-4-ylcyclopentyl)-3-thiophen-2-ylpropan-1-ol
CID 79059782
1-(2-methyloxan-2-yl)-3-(1-methylpyrazol-4-yl)propan-1-amine
CID 103011693
1-(1-methylcyclopentyl)-3-(1-methylpyrazol-4-yl)propan-1-amine
CID 103029892
1-(1-morpholin-4-ylcyclopentyl)hex-4-yn-1-ol
CID 113455139
3-methyl-1-(1-morpholin-4-ylcyclopentyl)hexan-1-ol
CID 79060616
2-(4-bromophenyl)-1-(1-morpholin-4-ylcyclopentyl)ethanol
CID 79058275
1-(1-methoxy-4-methylcyclohexyl)-3-(1-methylpyrazol-4-yl)propan-1-ol
CID 103008613
4-methyl-1-(1-methylpyrazol-4-yl)-4-morpholin-4-ylhexan-3-amine
CID 103011088
1-[2-(1-methylpyrazol-4-yl)ethyl]cyclopentan-1-ol
CID 103005734

Frequently Asked Questions

What is the IUPAC name of 3-(1-methylpyrazol-4-yl)-1-(1-morpholin-4-ylcyclopentyl)propan-1-ol?
The IUPAC name of 3-(1-methylpyrazol-4-yl)-1-(1-morpholin-4-ylcyclopentyl)propan-1-ol (CID 103008326) is 3-(1-methylpyrazol-4-yl)-1-(1-morpholin-4-ylcyclopentyl)propan-1-ol.
What is the SMILES notation for 3-(1-methylpyrazol-4-yl)-1-(1-morpholin-4-ylcyclopentyl)propan-1-ol?
The canonical SMILES for 3-(1-methylpyrazol-4-yl)-1-(1-morpholin-4-ylcyclopentyl)propan-1-ol is Cn1cc(CCC(O)C2(N3CCOCC3)CCCC2)cn1.
What is the InChIKey of 3-(1-methylpyrazol-4-yl)-1-(1-morpholin-4-ylcyclopentyl)propan-1-ol?
The InChIKey is WWNAYJKUHWZXST-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O2/c1-18-13-14(12-17-18)4-5-15(20)16(6-2-3-7-16)19-8-10-21-11-9-19/h12-13,15,20H,2-11H2,1H3.
What are the key properties of 3-(1-methylpyrazol-4-yl)-1-(1-morpholin-4-ylcyclopentyl)propan-1-ol?
3-(1-methylpyrazol-4-yl)-1-(1-morpholin-4-ylcyclopentyl)propan-1-ol has a molecular weight of 293.41 g/mol, XLogP of 1.36, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-methylpyrazol-4-yl)-1-(1-morpholin-4-ylcyclopentyl)propan-1-ol is sourced from PubChem (CID 103008326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).