2-cyclopropyl-3-(4-ethoxypiperidin-1-yl)-2-(methylamino)propan-1-ol

C14H28N2O2 — CID 64827067

IUPAC2-cyclopropyl-3-(4-ethoxypiperidin-1-yl)-2-(methylamino)propan-1-ol
SMILESCCOC1CCN(CC(CO)(NC)C2CC2)CC1
InChIInChI=1S/C14H28N2O2/c1-3-18-13-6-8-16(9-7-13)10-14(11-17,15-2)12-4-5-12/h12-13,15,17H,3-11H2,1-2H3
InChIKeyDDKDQSMILDUNBW-UHFFFAOYSA-N
MW256.39 g/mol
LogP0.85
Rot. Bonds7

About 2-cyclopropyl-3-(4-ethoxypiperidin-1-yl)-2-(methylamino)propan-1-ol

2-cyclopropyl-3-(4-ethoxypiperidin-1-yl)-2-(methylamino)propan-1-ol (PubChem CID 64827067) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 2-cyclopropyl-3-(4-ethoxypiperidin-1-yl)-2-(methylamino)propan-1-ol.

Molecular Properties

Compound Name2-cyclopropyl-3-(4-ethoxypiperidin-1-yl)-2-(methylamino)propan-1-ol
PubChem CID64827067
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name2-cyclopropyl-3-(4-ethoxypiperidin-1-yl)-2-(methylamino)propan-1-ol
SMILESCCOC1CCN(CC(CO)(NC)C2CC2)CC1
InChIInChI=1S/C14H28N2O2/c1-3-18-13-6-8-16(9-7-13)10-14(11-17,15-2)12-4-5-12/h12-13,15,17H,3-11H2,1-2H3
InChIKeyDDKDQSMILDUNBW-UHFFFAOYSA-N
XLogP0.85
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclopropyl-2-(methylamino)-3-(4-propan-2-ylpiperidin-1-yl)propan-1-ol
CID 103504047
2-amino-2-cyclopropyl-3-(4-ethoxypiperidin-1-yl)propan-1-ol
CID 64827068
2-cyclopropyl-3-(3-ethylpiperidin-1-yl)-2-(methylamino)propan-1-ol
CID 64795789
4-(4-ethoxypiperidin-1-yl)-2-methyl-2-(methylamino)butan-1-ol
CID 64825671
2-cyclopropyl-2-(cyclopropylamino)-3-(3-ethoxypiperidin-1-yl)propan-1-ol
CID 64827430
2-cyclopropyl-3-(4-ethyl-3-methylpiperazin-1-yl)-2-(methylamino)propan-1-ol
CID 64788433
2-cyclopropyl-2-(cyclopropylamino)-3-(4-methylpiperidin-1-yl)propan-1-ol
CID 64797554
2-cyclopropyl-3-(3-methoxy-3-methylpiperidin-1-yl)-2-(methylamino)propan-1-ol
CID 107395999
2-cyclopropyl-2-(cyclopropylamino)-3-(3-methoxypyrrolidin-1-yl)propan-1-ol
CID 103540761
3-(4-ethoxypiperidin-1-yl)-N-ethyl-2,2-dimethylpropan-1-amine
CID 62256195
2-cyclopropyl-3-(2-ethylpiperidin-1-yl)-2-(methylamino)propan-1-ol
CID 64797230
3-[4-(2-hydroxyethoxy)piperidin-1-yl]-2,2-dimethylpropan-1-ol
CID 115773133

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-3-(4-ethoxypiperidin-1-yl)-2-(methylamino)propan-1-ol?
The IUPAC name of 2-cyclopropyl-3-(4-ethoxypiperidin-1-yl)-2-(methylamino)propan-1-ol (CID 64827067) is 2-cyclopropyl-3-(4-ethoxypiperidin-1-yl)-2-(methylamino)propan-1-ol.
What is the SMILES notation for 2-cyclopropyl-3-(4-ethoxypiperidin-1-yl)-2-(methylamino)propan-1-ol?
The canonical SMILES for 2-cyclopropyl-3-(4-ethoxypiperidin-1-yl)-2-(methylamino)propan-1-ol is CCOC1CCN(CC(CO)(NC)C2CC2)CC1.
What is the InChIKey of 2-cyclopropyl-3-(4-ethoxypiperidin-1-yl)-2-(methylamino)propan-1-ol?
The InChIKey is DDKDQSMILDUNBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-3-18-13-6-8-16(9-7-13)10-14(11-17,15-2)12-4-5-12/h12-13,15,17H,3-11H2,1-2H3.
What are the key properties of 2-cyclopropyl-3-(4-ethoxypiperidin-1-yl)-2-(methylamino)propan-1-ol?
2-cyclopropyl-3-(4-ethoxypiperidin-1-yl)-2-(methylamino)propan-1-ol has a molecular weight of 256.39 g/mol, XLogP of 0.85, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-3-(4-ethoxypiperidin-1-yl)-2-(methylamino)propan-1-ol is sourced from PubChem (CID 64827067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).