5-fluoro-4-[4-(morpholin-4-ylmethyl)piperidin-1-yl]piperidin-3-amine

C15H29FN4O — CID 130280097

IUPAC5-fluoro-4-[4-(morpholin-4-ylmethyl)piperidin-1-yl]piperidin-3-amine
SMILESNC1CNCC(F)C1N1CCC(CN2CCOCC2)CC1
InChIInChI=1S/C15H29FN4O/c16-13-9-18-10-14(17)15(13)20-3-1-12(2-4-20)11-19-5-7-21-8-6-19/h12-15,18H,1-11,17H2
InChIKeySTHIHZJRINYDPR-UHFFFAOYSA-N
MW300.42 g/mol
LogP-0.33
Rot. Bonds3

About 5-fluoro-4-[4-(morpholin-4-ylmethyl)piperidin-1-yl]piperidin-3-amine

5-fluoro-4-[4-(morpholin-4-ylmethyl)piperidin-1-yl]piperidin-3-amine (PubChem CID 130280097) has the molecular formula C15H29FN4O and a molecular weight of 300.42 g/mol. Its IUPAC name is 5-fluoro-4-[4-(morpholin-4-ylmethyl)piperidin-1-yl]piperidin-3-amine.

Molecular Properties

Compound Name5-fluoro-4-[4-(morpholin-4-ylmethyl)piperidin-1-yl]piperidin-3-amine
PubChem CID130280097
Molecular FormulaC15H29FN4O
Molecular Weight300.42 g/mol
Exact Mass300.23
IUPAC Name5-fluoro-4-[4-(morpholin-4-ylmethyl)piperidin-1-yl]piperidin-3-amine
SMILESNC1CNCC(F)C1N1CCC(CN2CCOCC2)CC1
InChIInChI=1S/C15H29FN4O/c16-13-9-18-10-14(17)15(13)20-3-1-12(2-4-20)11-19-5-7-21-8-6-19/h12-15,18H,1-11,17H2
InChIKeySTHIHZJRINYDPR-UHFFFAOYSA-N
XLogP-0.33
TPSA53.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.42
LogP ≤ 5-0.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-4-[4-(morpholin-4-ylmethyl)piperidin-1-yl]piperidin-3-amine?
The IUPAC name of 5-fluoro-4-[4-(morpholin-4-ylmethyl)piperidin-1-yl]piperidin-3-amine (CID 130280097) is 5-fluoro-4-[4-(morpholin-4-ylmethyl)piperidin-1-yl]piperidin-3-amine.
What is the SMILES notation for 5-fluoro-4-[4-(morpholin-4-ylmethyl)piperidin-1-yl]piperidin-3-amine?
The canonical SMILES for 5-fluoro-4-[4-(morpholin-4-ylmethyl)piperidin-1-yl]piperidin-3-amine is NC1CNCC(F)C1N1CCC(CN2CCOCC2)CC1.
What is the InChIKey of 5-fluoro-4-[4-(morpholin-4-ylmethyl)piperidin-1-yl]piperidin-3-amine?
The InChIKey is STHIHZJRINYDPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29FN4O/c16-13-9-18-10-14(17)15(13)20-3-1-12(2-4-20)11-19-5-7-21-8-6-19/h12-15,18H,1-11,17H2.
What are the key properties of 5-fluoro-4-[4-(morpholin-4-ylmethyl)piperidin-1-yl]piperidin-3-amine?
5-fluoro-4-[4-(morpholin-4-ylmethyl)piperidin-1-yl]piperidin-3-amine has a molecular weight of 300.42 g/mol, XLogP of -0.33, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-4-[4-(morpholin-4-ylmethyl)piperidin-1-yl]piperidin-3-amine is sourced from PubChem (CID 130280097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).