2-amino-2-cyclopropyl-3-(4,4-diethylpiperidin-1-yl)propan-1-ol

C15H30N2O — CID 64791296

IUPAC2-amino-2-cyclopropyl-3-(4,4-diethylpiperidin-1-yl)propan-1-ol
SMILESCCC1(CC)CCN(CC(N)(CO)C2CC2)CC1
InChIInChI=1S/C15H30N2O/c1-3-14(4-2)7-9-17(10-8-14)11-15(16,12-18)13-5-6-13/h13,18H,3-12,16H2,1-2H3
InChIKeyRPUDBMCQQWWEJD-UHFFFAOYSA-N
MW254.42 g/mol
LogP1.99
Rot. Bonds6

About 2-amino-2-cyclopropyl-3-(4,4-diethylpiperidin-1-yl)propan-1-ol

2-amino-2-cyclopropyl-3-(4,4-diethylpiperidin-1-yl)propan-1-ol (PubChem CID 64791296) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 2-amino-2-cyclopropyl-3-(4,4-diethylpiperidin-1-yl)propan-1-ol.

Molecular Properties

Compound Name2-amino-2-cyclopropyl-3-(4,4-diethylpiperidin-1-yl)propan-1-ol
PubChem CID64791296
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name2-amino-2-cyclopropyl-3-(4,4-diethylpiperidin-1-yl)propan-1-ol
SMILESCCC1(CC)CCN(CC(N)(CO)C2CC2)CC1
InChIInChI=1S/C15H30N2O/c1-3-14(4-2)7-9-17(10-8-14)11-15(16,12-18)13-5-6-13/h13,18H,3-12,16H2,1-2H3
InChIKeyRPUDBMCQQWWEJD-UHFFFAOYSA-N
XLogP1.99
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-2-cyclopropyl-3-(4,4-diethylpiperidin-1-yl)propan-1-ol?
The IUPAC name of 2-amino-2-cyclopropyl-3-(4,4-diethylpiperidin-1-yl)propan-1-ol (CID 64791296) is 2-amino-2-cyclopropyl-3-(4,4-diethylpiperidin-1-yl)propan-1-ol.
What is the SMILES notation for 2-amino-2-cyclopropyl-3-(4,4-diethylpiperidin-1-yl)propan-1-ol?
The canonical SMILES for 2-amino-2-cyclopropyl-3-(4,4-diethylpiperidin-1-yl)propan-1-ol is CCC1(CC)CCN(CC(N)(CO)C2CC2)CC1.
What is the InChIKey of 2-amino-2-cyclopropyl-3-(4,4-diethylpiperidin-1-yl)propan-1-ol?
The InChIKey is RPUDBMCQQWWEJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-3-14(4-2)7-9-17(10-8-14)11-15(16,12-18)13-5-6-13/h13,18H,3-12,16H2,1-2H3.
What are the key properties of 2-amino-2-cyclopropyl-3-(4,4-diethylpiperidin-1-yl)propan-1-ol?
2-amino-2-cyclopropyl-3-(4,4-diethylpiperidin-1-yl)propan-1-ol has a molecular weight of 254.42 g/mol, XLogP of 1.99, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-cyclopropyl-3-(4,4-diethylpiperidin-1-yl)propan-1-ol is sourced from PubChem (CID 64791296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).