2-[(3R)-4-amino-1-propan-2-ylpiperidin-3-yl]oxyethanol

C10H22N2O2 — CID 134177883

IUPAC2-[(3R)-4-amino-1-propan-2-ylpiperidin-3-yl]oxyethanol
SMILESCC(C)N1CCC(N)[C@H](OCCO)C1
InChIInChI=1S/C10H22N2O2/c1-8(2)12-4-3-9(11)10(7-12)14-6-5-13/h8-10,13H,3-7,11H2,1-2H3/t9?,10-/m1/s1
InChIKeyNOEHPPDSZZUJIP-QVDQXJPCSA-N
MW202.30 g/mol
LogP-0.19
Rot. Bonds4

About 2-[(3R)-4-amino-1-propan-2-ylpiperidin-3-yl]oxyethanol

2-[(3R)-4-amino-1-propan-2-ylpiperidin-3-yl]oxyethanol (PubChem CID 134177883) has the molecular formula C10H22N2O2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 2-[(3R)-4-amino-1-propan-2-ylpiperidin-3-yl]oxyethanol.

Molecular Properties

Compound Name2-[(3R)-4-amino-1-propan-2-ylpiperidin-3-yl]oxyethanol
PubChem CID134177883
Molecular FormulaC10H22N2O2
Molecular Weight202.30 g/mol
Exact Mass202.17
IUPAC Name2-[(3R)-4-amino-1-propan-2-ylpiperidin-3-yl]oxyethanol
SMILESCC(C)N1CCC(N)[C@H](OCCO)C1
InChIInChI=1S/C10H22N2O2/c1-8(2)12-4-3-9(11)10(7-12)14-6-5-13/h8-10,13H,3-7,11H2,1-2H3/t9?,10-/m1/s1
InChIKeyNOEHPPDSZZUJIP-QVDQXJPCSA-N
XLogP-0.19
TPSA58.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 5-0.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(3R)-4-amino-1-propan-2-ylpiperidin-3-yl]oxyethanol?
The IUPAC name of 2-[(3R)-4-amino-1-propan-2-ylpiperidin-3-yl]oxyethanol (CID 134177883) is 2-[(3R)-4-amino-1-propan-2-ylpiperidin-3-yl]oxyethanol.
What is the SMILES notation for 2-[(3R)-4-amino-1-propan-2-ylpiperidin-3-yl]oxyethanol?
The canonical SMILES for 2-[(3R)-4-amino-1-propan-2-ylpiperidin-3-yl]oxyethanol is CC(C)N1CCC(N)[C@H](OCCO)C1.
What is the InChIKey of 2-[(3R)-4-amino-1-propan-2-ylpiperidin-3-yl]oxyethanol?
The InChIKey is NOEHPPDSZZUJIP-QVDQXJPCSA-N. The full InChI is InChI=1S/C10H22N2O2/c1-8(2)12-4-3-9(11)10(7-12)14-6-5-13/h8-10,13H,3-7,11H2,1-2H3/t9?,10-/m1/s1.
What are the key properties of 2-[(3R)-4-amino-1-propan-2-ylpiperidin-3-yl]oxyethanol?
2-[(3R)-4-amino-1-propan-2-ylpiperidin-3-yl]oxyethanol has a molecular weight of 202.30 g/mol, XLogP of -0.19, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3R)-4-amino-1-propan-2-ylpiperidin-3-yl]oxyethanol is sourced from PubChem (CID 134177883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).