(1R)-1-[2-[4-(cyclopropylmethyl)piperazin-1-yl]phenyl]propan-1-ol

C17H26N2O — CID 103959883

IUPAC(1R)-1-[2-[4-(cyclopropylmethyl)piperazin-1-yl]phenyl]propan-1-ol
SMILESCC[C@@H](O)c1ccccc1N1CCN(CC2CC2)CC1
InChIInChI=1S/C17H26N2O/c1-2-17(20)15-5-3-4-6-16(15)19-11-9-18(10-12-19)13-14-7-8-14/h3-6,14,17,20H,2,7-13H2,1H3/t17-/m1/s1
InChIKeyLHLZIJKSYMFEMP-QGZVFWFLSA-N
MW274.41 g/mol
LogP2.66
Rot. Bonds5

About (1R)-1-[2-[4-(cyclopropylmethyl)piperazin-1-yl]phenyl]propan-1-ol

(1R)-1-[2-[4-(cyclopropylmethyl)piperazin-1-yl]phenyl]propan-1-ol (PubChem CID 103959883) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is (1R)-1-[2-[4-(cyclopropylmethyl)piperazin-1-yl]phenyl]propan-1-ol.

Molecular Properties

Compound Name(1R)-1-[2-[4-(cyclopropylmethyl)piperazin-1-yl]phenyl]propan-1-ol
PubChem CID103959883
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC Name(1R)-1-[2-[4-(cyclopropylmethyl)piperazin-1-yl]phenyl]propan-1-ol
SMILESCC[C@@H](O)c1ccccc1N1CCN(CC2CC2)CC1
InChIInChI=1S/C17H26N2O/c1-2-17(20)15-5-3-4-6-16(15)19-11-9-18(10-12-19)13-14-7-8-14/h3-6,14,17,20H,2,7-13H2,1H3/t17-/m1/s1
InChIKeyLHLZIJKSYMFEMP-QGZVFWFLSA-N
XLogP2.66
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1R)-1-[2-[4-(2-methylpropyl)piperazin-1-yl]phenyl]propan-1-ol
CID 103960079
(1R)-1-[2-(4-ethylazepan-1-yl)phenyl]propan-1-ol
CID 103960194
1-[2-(4-cyclopentylpiperazin-1-yl)phenyl]propan-1-ol
CID 115995985
(1R)-1-[2-(4-cyclopentylpiperazin-1-yl)phenyl]propan-1-ol
CID 103960071
1-[2-[4-(cyclopropylmethyl)piperazin-1-yl]phenyl]-N-ethylethanamine
CID 61441210
1-[2-[4-(1-hydroxyethyl)piperidin-1-yl]phenyl]propan-1-ol
CID 106836517
(1R)-1-(2-piperidin-1-ylphenyl)propan-1-ol
CID 103959701
(1S)-1-[2-[4-(dimethylamino)piperidin-1-yl]phenyl]propan-1-ol
CID 103959777
1-[2-(3-ethylpiperidin-1-yl)phenyl]propan-1-ol
CID 112678826
(1S)-1-[2-[4-[(dimethylamino)methyl]piperidin-1-yl]phenyl]propan-1-ol
CID 103959921
(1R)-1-[2-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)phenyl]propan-1-ol
CID 103960202
2-[1-[2-(1-hydroxypropyl)phenyl]piperidin-4-yl]acetamide
CID 115995958

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[2-[4-(cyclopropylmethyl)piperazin-1-yl]phenyl]propan-1-ol?
The IUPAC name of (1R)-1-[2-[4-(cyclopropylmethyl)piperazin-1-yl]phenyl]propan-1-ol (CID 103959883) is (1R)-1-[2-[4-(cyclopropylmethyl)piperazin-1-yl]phenyl]propan-1-ol.
What is the SMILES notation for (1R)-1-[2-[4-(cyclopropylmethyl)piperazin-1-yl]phenyl]propan-1-ol?
The canonical SMILES for (1R)-1-[2-[4-(cyclopropylmethyl)piperazin-1-yl]phenyl]propan-1-ol is CC[C@@H](O)c1ccccc1N1CCN(CC2CC2)CC1.
What is the InChIKey of (1R)-1-[2-[4-(cyclopropylmethyl)piperazin-1-yl]phenyl]propan-1-ol?
The InChIKey is LHLZIJKSYMFEMP-QGZVFWFLSA-N. The full InChI is InChI=1S/C17H26N2O/c1-2-17(20)15-5-3-4-6-16(15)19-11-9-18(10-12-19)13-14-7-8-14/h3-6,14,17,20H,2,7-13H2,1H3/t17-/m1/s1.
What are the key properties of (1R)-1-[2-[4-(cyclopropylmethyl)piperazin-1-yl]phenyl]propan-1-ol?
(1R)-1-[2-[4-(cyclopropylmethyl)piperazin-1-yl]phenyl]propan-1-ol has a molecular weight of 274.41 g/mol, XLogP of 2.66, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[2-[4-(cyclopropylmethyl)piperazin-1-yl]phenyl]propan-1-ol is sourced from PubChem (CID 103959883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).