2-[cyclopentyl-[(1-propan-2-ylpyrazol-3-yl)methyl]amino]ethanol

C14H25N3O — CID 64773013

IUPAC2-[cyclopentyl-[(1-propan-2-ylpyrazol-3-yl)methyl]amino]ethanol
SMILESCC(C)n1ccc(CN(CCO)C2CCCC2)n1
InChIInChI=1S/C14H25N3O/c1-12(2)17-8-7-13(15-17)11-16(9-10-18)14-5-3-4-6-14/h7-8,12,14,18H,3-6,9-11H2,1-2H3
InChIKeyPFMOEFRURSQHCY-UHFFFAOYSA-N
MW251.37 g/mol
LogP2.20
Rot. Bonds6

About 2-[cyclopentyl-[(1-propan-2-ylpyrazol-3-yl)methyl]amino]ethanol

2-[cyclopentyl-[(1-propan-2-ylpyrazol-3-yl)methyl]amino]ethanol (PubChem CID 64773013) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is 2-[cyclopentyl-[(1-propan-2-ylpyrazol-3-yl)methyl]amino]ethanol.

Molecular Properties

Compound Name2-[cyclopentyl-[(1-propan-2-ylpyrazol-3-yl)methyl]amino]ethanol
PubChem CID64773013
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC Name2-[cyclopentyl-[(1-propan-2-ylpyrazol-3-yl)methyl]amino]ethanol
SMILESCC(C)n1ccc(CN(CCO)C2CCCC2)n1
InChIInChI=1S/C14H25N3O/c1-12(2)17-8-7-13(15-17)11-16(9-10-18)14-5-3-4-6-14/h7-8,12,14,18H,3-6,9-11H2,1-2H3
InChIKeyPFMOEFRURSQHCY-UHFFFAOYSA-N
XLogP2.20
TPSA41.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[cyclopentyl-[(1-methylpyrazol-3-yl)methyl]amino]ethanol
CID 82878038
3-[cyclopropyl-[(1-propan-2-ylpyrazol-3-yl)methyl]amino]propanenitrile
CID 64773625
3-[cyclopropyl-[(1-propan-2-ylpyrazol-3-yl)methyl]amino]propanethioamide
CID 64772003
2-[cyclopropyl-[(1-propan-2-ylpyrazol-3-yl)methyl]amino]acetic acid
CID 64771325
N-[(1-butan-2-ylpyrazol-3-yl)methyl]-N-(3-chloropropyl)cyclobutanamine
CID 102860421
N-[(1-propan-2-ylpyrazol-3-yl)methyl]-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
CID 64771331
2-[pentan-3-yl-[(1-propan-2-ylpyrazol-3-yl)methyl]amino]ethanol
CID 64773175
N'-cyclopentyl-N'-[(1-methylpyrazol-3-yl)methyl]ethane-1,2-diamine
CID 82866285
2-[cyclopentyl(pyrazin-2-ylmethyl)amino]ethanol
CID 62016639
2-[cyclopentyl-[(2-methyltetrazol-5-yl)methyl]amino]ethanol
CID 107052538
4-[methyl-[(1-propan-2-ylpyrazol-3-yl)methyl]amino]cyclohexan-1-one
CID 79120244
2-[cyclohexyl-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]amino]ethanol
CID 60694876

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl-[(1-propan-2-ylpyrazol-3-yl)methyl]amino]ethanol?
The IUPAC name of 2-[cyclopentyl-[(1-propan-2-ylpyrazol-3-yl)methyl]amino]ethanol (CID 64773013) is 2-[cyclopentyl-[(1-propan-2-ylpyrazol-3-yl)methyl]amino]ethanol.
What is the SMILES notation for 2-[cyclopentyl-[(1-propan-2-ylpyrazol-3-yl)methyl]amino]ethanol?
The canonical SMILES for 2-[cyclopentyl-[(1-propan-2-ylpyrazol-3-yl)methyl]amino]ethanol is CC(C)n1ccc(CN(CCO)C2CCCC2)n1.
What is the InChIKey of 2-[cyclopentyl-[(1-propan-2-ylpyrazol-3-yl)methyl]amino]ethanol?
The InChIKey is PFMOEFRURSQHCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O/c1-12(2)17-8-7-13(15-17)11-16(9-10-18)14-5-3-4-6-14/h7-8,12,14,18H,3-6,9-11H2,1-2H3.
What are the key properties of 2-[cyclopentyl-[(1-propan-2-ylpyrazol-3-yl)methyl]amino]ethanol?
2-[cyclopentyl-[(1-propan-2-ylpyrazol-3-yl)methyl]amino]ethanol has a molecular weight of 251.37 g/mol, XLogP of 2.20, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl-[(1-propan-2-ylpyrazol-3-yl)methyl]amino]ethanol is sourced from PubChem (CID 64773013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).