2-[1-[(4-propan-2-ylmorpholin-2-yl)methyl]piperidin-3-yl]ethanamine

C15H31N3O — CID 64532949

IUPAC2-[1-[(4-propan-2-ylmorpholin-2-yl)methyl]piperidin-3-yl]ethanamine
SMILESCC(C)N1CCOC(CN2CCCC(CCN)C2)C1
InChIInChI=1S/C15H31N3O/c1-13(2)18-8-9-19-15(12-18)11-17-7-3-4-14(10-17)5-6-16/h13-15H,3-12,16H2,1-2H3
InChIKeyHCFPFWUDSVWRSZ-UHFFFAOYSA-N
MW269.43 g/mol
LogP1.16
Rot. Bonds5

About 2-[1-[(4-propan-2-ylmorpholin-2-yl)methyl]piperidin-3-yl]ethanamine

2-[1-[(4-propan-2-ylmorpholin-2-yl)methyl]piperidin-3-yl]ethanamine (PubChem CID 64532949) has the molecular formula C15H31N3O and a molecular weight of 269.43 g/mol. Its IUPAC name is 2-[1-[(4-propan-2-ylmorpholin-2-yl)methyl]piperidin-3-yl]ethanamine.

Molecular Properties

Compound Name2-[1-[(4-propan-2-ylmorpholin-2-yl)methyl]piperidin-3-yl]ethanamine
PubChem CID64532949
Molecular FormulaC15H31N3O
Molecular Weight269.43 g/mol
Exact Mass269.25
IUPAC Name2-[1-[(4-propan-2-ylmorpholin-2-yl)methyl]piperidin-3-yl]ethanamine
SMILESCC(C)N1CCOC(CN2CCCC(CCN)C2)C1
InChIInChI=1S/C15H31N3O/c1-13(2)18-8-9-19-15(12-18)11-17-7-3-4-14(10-17)5-6-16/h13-15H,3-12,16H2,1-2H3
InChIKeyHCFPFWUDSVWRSZ-UHFFFAOYSA-N
XLogP1.16
TPSA41.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[3-(chloromethyl)piperidin-1-yl]methyl]-4-propan-2-ylmorpholine
CID 64534748
2-[1-(oxan-2-ylmethyl)piperidin-3-yl]ethanamine
CID 63762643
2-[4-[(4-propan-2-ylmorpholin-2-yl)methyl]-1,4-diazepan-1-yl]ethanamine
CID 64533682
1-[1-[(4-propan-2-ylmorpholin-2-yl)methyl]piperidin-3-yl]ethanone
CID 64532918
4-methyl-1-[(4-propan-2-ylmorpholin-2-yl)methyl]piperidin-3-amine
CID 64532750
3-ethyl-1-[(4-propan-2-ylmorpholin-2-yl)methyl]piperidin-4-amine
CID 81458873
2-[1-[(4-methylmorpholin-2-yl)methyl]piperidin-3-yl]ethanol
CID 112734129
2-[[4-(2-bromoethyl)-1,4-diazepan-1-yl]methyl]-4-propan-2-ylmorpholine
CID 80667744
2-[(3S)-1-propan-2-ylpyrrolidin-3-yl]ethanamine
CID 94058250
8-[(4-propan-2-ylmorpholin-2-yl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane
CID 78994145
1-[(4-propan-2-ylmorpholin-2-yl)methyl]pyrrolidine-3-carboxylic acid
CID 64532739
2-[1-[(4-methylmorpholin-2-yl)methyl]piperidin-4-yl]ethanamine
CID 79172349

Frequently Asked Questions

What is the IUPAC name of 2-[1-[(4-propan-2-ylmorpholin-2-yl)methyl]piperidin-3-yl]ethanamine?
The IUPAC name of 2-[1-[(4-propan-2-ylmorpholin-2-yl)methyl]piperidin-3-yl]ethanamine (CID 64532949) is 2-[1-[(4-propan-2-ylmorpholin-2-yl)methyl]piperidin-3-yl]ethanamine.
What is the SMILES notation for 2-[1-[(4-propan-2-ylmorpholin-2-yl)methyl]piperidin-3-yl]ethanamine?
The canonical SMILES for 2-[1-[(4-propan-2-ylmorpholin-2-yl)methyl]piperidin-3-yl]ethanamine is CC(C)N1CCOC(CN2CCCC(CCN)C2)C1.
What is the InChIKey of 2-[1-[(4-propan-2-ylmorpholin-2-yl)methyl]piperidin-3-yl]ethanamine?
The InChIKey is HCFPFWUDSVWRSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O/c1-13(2)18-8-9-19-15(12-18)11-17-7-3-4-14(10-17)5-6-16/h13-15H,3-12,16H2,1-2H3.
What are the key properties of 2-[1-[(4-propan-2-ylmorpholin-2-yl)methyl]piperidin-3-yl]ethanamine?
2-[1-[(4-propan-2-ylmorpholin-2-yl)methyl]piperidin-3-yl]ethanamine has a molecular weight of 269.43 g/mol, XLogP of 1.16, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(4-propan-2-ylmorpholin-2-yl)methyl]piperidin-3-yl]ethanamine is sourced from PubChem (CID 64532949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).