4-[(2-methylpiperidin-1-yl)methyl]-N-propyloxolan-3-amine

C14H28N2O — CID 66256953

IUPAC4-[(2-methylpiperidin-1-yl)methyl]-N-propyloxolan-3-amine
SMILESCCCNC1COCC1CN1CCCCC1C
InChIInChI=1S/C14H28N2O/c1-3-7-15-14-11-17-10-13(14)9-16-8-5-4-6-12(16)2/h12-15H,3-11H2,1-2H3
InChIKeyIEYGRQHJQYQLJL-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.88
Rot. Bonds5

About 4-[(2-methylpiperidin-1-yl)methyl]-N-propyloxolan-3-amine

4-[(2-methylpiperidin-1-yl)methyl]-N-propyloxolan-3-amine (PubChem CID 66256953) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 4-[(2-methylpiperidin-1-yl)methyl]-N-propyloxolan-3-amine.

Molecular Properties

Compound Name4-[(2-methylpiperidin-1-yl)methyl]-N-propyloxolan-3-amine
PubChem CID66256953
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name4-[(2-methylpiperidin-1-yl)methyl]-N-propyloxolan-3-amine
SMILESCCCNC1COCC1CN1CCCCC1C
InChIInChI=1S/C14H28N2O/c1-3-7-15-14-11-17-10-13(14)9-16-8-5-4-6-12(16)2/h12-15H,3-11H2,1-2H3
InChIKeyIEYGRQHJQYQLJL-UHFFFAOYSA-N
XLogP1.88
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-3-[(2-methylazepan-1-yl)methyl]oxan-4-amine
CID 103060277
4-[(2-methylpiperidin-1-yl)methyl]oxolan-3-amine
CID 66238123
2-[(3-methylmorpholin-4-yl)methyl]-N-propylcyclohexan-1-amine
CID 62616709
4-[(3-ethylmorpholin-4-yl)methyl]-N-propyloxolan-3-amine
CID 66255623
4-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-ylmethyl)-N-propyloxolan-3-amine
CID 113335831
N-ethyl-4-[(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)methyl]oxolan-3-amine
CID 79934970
4-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-ylmethyl)-N-ethyloxolan-3-amine
CID 66259711
N-propyl-4-[(4-propylazepan-1-yl)methyl]oxolan-3-amine
CID 66255259
4-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)-N-propyloxolan-3-amine
CID 66371661
3-[(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)methyl]-N-propyloxan-4-amine
CID 103061064
2-[(2-methylpyrrolidin-1-yl)methyl]-4-propan-2-yl-N-propylcyclohexan-1-amine
CID 63483028
4-[(3-methoxypyrrolidin-1-yl)methyl]-N-propyloxolan-3-amine
CID 103534665

Frequently Asked Questions

What is the IUPAC name of 4-[(2-methylpiperidin-1-yl)methyl]-N-propyloxolan-3-amine?
The IUPAC name of 4-[(2-methylpiperidin-1-yl)methyl]-N-propyloxolan-3-amine (CID 66256953) is 4-[(2-methylpiperidin-1-yl)methyl]-N-propyloxolan-3-amine.
What is the SMILES notation for 4-[(2-methylpiperidin-1-yl)methyl]-N-propyloxolan-3-amine?
The canonical SMILES for 4-[(2-methylpiperidin-1-yl)methyl]-N-propyloxolan-3-amine is CCCNC1COCC1CN1CCCCC1C.
What is the InChIKey of 4-[(2-methylpiperidin-1-yl)methyl]-N-propyloxolan-3-amine?
The InChIKey is IEYGRQHJQYQLJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-3-7-15-14-11-17-10-13(14)9-16-8-5-4-6-12(16)2/h12-15H,3-11H2,1-2H3.
What are the key properties of 4-[(2-methylpiperidin-1-yl)methyl]-N-propyloxolan-3-amine?
4-[(2-methylpiperidin-1-yl)methyl]-N-propyloxolan-3-amine has a molecular weight of 240.39 g/mol, XLogP of 1.88, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methylpiperidin-1-yl)methyl]-N-propyloxolan-3-amine is sourced from PubChem (CID 66256953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).