1-[(1-methylpyrrolidin-3-yl)amino]-3-phenylmethoxypropan-2-ol

C15H24N2O2 — CID 61462412

IUPAC1-[(1-methylpyrrolidin-3-yl)amino]-3-phenylmethoxypropan-2-ol
SMILESCN1CCC(NCC(O)COCc2ccccc2)C1
InChIInChI=1S/C15H24N2O2/c1-17-8-7-14(10-17)16-9-15(18)12-19-11-13-5-3-2-4-6-13/h2-6,14-16,18H,7-12H2,1H3
InChIKeySIUPYANTGDIZNM-UHFFFAOYSA-N
MW264.37 g/mol
LogP0.86
Rot. Bonds7

About 1-[(1-methylpyrrolidin-3-yl)amino]-3-phenylmethoxypropan-2-ol

1-[(1-methylpyrrolidin-3-yl)amino]-3-phenylmethoxypropan-2-ol (PubChem CID 61462412) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 1-[(1-methylpyrrolidin-3-yl)amino]-3-phenylmethoxypropan-2-ol.

Molecular Properties

Compound Name1-[(1-methylpyrrolidin-3-yl)amino]-3-phenylmethoxypropan-2-ol
PubChem CID61462412
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name1-[(1-methylpyrrolidin-3-yl)amino]-3-phenylmethoxypropan-2-ol
SMILESCN1CCC(NCC(O)COCc2ccccc2)C1
InChIInChI=1S/C15H24N2O2/c1-17-8-7-14(10-17)16-9-15(18)12-19-11-13-5-3-2-4-6-13/h2-6,14-16,18H,7-12H2,1H3
InChIKeySIUPYANTGDIZNM-UHFFFAOYSA-N
XLogP0.86
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-[(1-methylpyrrolidin-3-yl)amino]-3-phenylmethoxypropan-2-ol with MolForge

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Related Compounds

1-[(1,3-dimethylpiperidin-4-yl)amino]-3-phenylmethoxypropan-2-ol
CID 115716647
1-(furan-2-ylmethoxy)-3-[(1-methylpyrrolidin-3-yl)amino]propan-2-ol
CID 54949730
1-[(3,4-dimethylcyclohexyl)amino]-3-phenylmethoxypropan-2-ol
CID 64742870
1-(1-azabicyclo[2.2.2]octan-3-ylamino)-3-phenylmethoxypropan-2-ol
CID 60901722
1-[(1-methylpiperidin-4-yl)amino]-3-phenylpropan-2-ol
CID 111755497
(2S)-1-phenylmethoxy-3-[[(3S)-1-pyridazin-3-ylpiperidin-3-yl]amino]propan-2-ol
CID 95610322
(2S)-1-[[(2R)-4-methylmorpholin-2-yl]methylamino]-3-phenylmethoxypropan-2-ol
CID 95751212
1-(4-fluorophenoxy)-3-[(1-methylpyrrolidin-3-yl)amino]propan-2-ol
CID 61462344
1-[(1-methylpiperidin-4-yl)amino]-3-(1-phenylethoxy)propan-2-ol
CID 60910129
1-[[(1R)-1-cyclopentylethyl]amino]-3-phenylmethoxypropan-2-ol
CID 81394514
1-(cyclopropylmethoxy)-3-[(1-methylpiperidin-4-yl)amino]propan-2-ol
CID 60909850
1-(2-cyclopropylpropylamino)-3-phenylmethoxypropan-2-ol
CID 115591857

Frequently Asked Questions

What is the IUPAC name of 1-[(1-methylpyrrolidin-3-yl)amino]-3-phenylmethoxypropan-2-ol?
The IUPAC name of 1-[(1-methylpyrrolidin-3-yl)amino]-3-phenylmethoxypropan-2-ol (CID 61462412) is 1-[(1-methylpyrrolidin-3-yl)amino]-3-phenylmethoxypropan-2-ol.
What is the SMILES notation for 1-[(1-methylpyrrolidin-3-yl)amino]-3-phenylmethoxypropan-2-ol?
The canonical SMILES for 1-[(1-methylpyrrolidin-3-yl)amino]-3-phenylmethoxypropan-2-ol is CN1CCC(NCC(O)COCc2ccccc2)C1.
What is the InChIKey of 1-[(1-methylpyrrolidin-3-yl)amino]-3-phenylmethoxypropan-2-ol?
The InChIKey is SIUPYANTGDIZNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-17-8-7-14(10-17)16-9-15(18)12-19-11-13-5-3-2-4-6-13/h2-6,14-16,18H,7-12H2,1H3.
What are the key properties of 1-[(1-methylpyrrolidin-3-yl)amino]-3-phenylmethoxypropan-2-ol?
1-[(1-methylpyrrolidin-3-yl)amino]-3-phenylmethoxypropan-2-ol has a molecular weight of 264.37 g/mol, XLogP of 0.86, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1-methylpyrrolidin-3-yl)amino]-3-phenylmethoxypropan-2-ol is sourced from PubChem (CID 61462412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).