2-cyclopropyl-3-(3-ethylpiperidin-1-yl)-2-(methylamino)propan-1-ol

C14H28N2O — CID 64795789

IUPAC2-cyclopropyl-3-(3-ethylpiperidin-1-yl)-2-(methylamino)propan-1-ol
SMILESCCC1CCCN(CC(CO)(NC)C2CC2)C1
InChIInChI=1S/C14H28N2O/c1-3-12-5-4-8-16(9-12)10-14(11-17,15-2)13-6-7-13/h12-13,15,17H,3-11H2,1-2H3
InChIKeyUZRRAGGKMSQFCE-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.47
Rot. Bonds6

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

2-cyclopropyl-3-(3-ethylpiperidin-1-yl)-2-(methylamino)propan-1-ol (PubChem CID 64795789) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 2-cyclopropyl-3-(3-ethylpiperidin-1-yl)-2-(methylamino)propan-1-ol.

Molecular Properties

Compound Name2-cyclopropyl-3-(3-ethylpiperidin-1-yl)-2-(methylamino)propan-1-ol
PubChem CID64795789
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name2-cyclopropyl-3-(3-ethylpiperidin-1-yl)-2-(methylamino)propan-1-ol
SMILESCCC1CCCN(CC(CO)(NC)C2CC2)C1
InChIInChI=1S/C14H28N2O/c1-3-12-5-4-8-16(9-12)10-14(11-17,15-2)13-6-7-13/h12-13,15,17H,3-11H2,1-2H3
InChIKeyUZRRAGGKMSQFCE-UHFFFAOYSA-N
XLogP1.47
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclopropyl-3-(4-ethyl-3-methylpiperazin-1-yl)-2-(methylamino)propan-1-ol
CID 64788433
2-cyclopropyl-2-(methylamino)-3-(4-propan-2-ylpiperidin-1-yl)propan-1-ol
CID 103504047
methyl 2-cyclopropyl-3-(3-ethylpiperidin-1-yl)-2-(methylamino)propanoate
CID 63911312
2-ethyl-2-[[3-(2-hydroxyethyl)piperidin-1-yl]methyl]butan-1-ol
CID 107229026
2-cyclopropyl-3-(4-ethoxypiperidin-1-yl)-2-(methylamino)propan-1-ol
CID 64827067
2-cyclopropyl-3-(2-ethylpiperidin-1-yl)-2-(methylamino)propan-1-ol
CID 64797230
1-(3-ethylpiperidin-1-yl)-2-methylbutan-2-ol
CID 114495376
2-cyclopropyl-2-(ethylamino)-3-(4-propylazepan-1-yl)propan-1-ol
CID 64809169
2-cyclopropyl-3-(3-methoxy-3-methylpiperidin-1-yl)-2-(methylamino)propan-1-ol
CID 107395999
2-cyclopropyl-3-(2,4-dimethyl-1,4-diazepan-1-yl)-2-(methylamino)propan-1-ol
CID 114087996
1-(3-ethylpiperidin-1-yl)-2,3-dimethylbutan-2-ol
CID 114447622
4-(3-ethylpiperidin-1-yl)-3,3-dimethylbutan-2-one
CID 66453803

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-3-(3-ethylpiperidin-1-yl)-2-(methylamino)propan-1-ol?
The IUPAC name of 2-cyclopropyl-3-(3-ethylpiperidin-1-yl)-2-(methylamino)propan-1-ol (CID 64795789) is 2-cyclopropyl-3-(3-ethylpiperidin-1-yl)-2-(methylamino)propan-1-ol.
What is the SMILES notation for 2-cyclopropyl-3-(3-ethylpiperidin-1-yl)-2-(methylamino)propan-1-ol?
The canonical SMILES for 2-cyclopropyl-3-(3-ethylpiperidin-1-yl)-2-(methylamino)propan-1-ol is CCC1CCCN(CC(CO)(NC)C2CC2)C1.
What is the InChIKey of 2-cyclopropyl-3-(3-ethylpiperidin-1-yl)-2-(methylamino)propan-1-ol?
The InChIKey is UZRRAGGKMSQFCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-3-12-5-4-8-16(9-12)10-14(11-17,15-2)13-6-7-13/h12-13,15,17H,3-11H2,1-2H3.
What are the key properties of 2-cyclopropyl-3-(3-ethylpiperidin-1-yl)-2-(methylamino)propan-1-ol?
2-cyclopropyl-3-(3-ethylpiperidin-1-yl)-2-(methylamino)propan-1-ol has a molecular weight of 240.39 g/mol, XLogP of 1.47, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-3-(3-ethylpiperidin-1-yl)-2-(methylamino)propan-1-ol is sourced from PubChem (CID 64795789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).