[1-cyclopropyl-3-(2,2,6-trimethylmorpholin-4-yl)pyrrolidin-3-yl]methanamine

C15H29N3O — CID 55142181

IUPAC[1-cyclopropyl-3-(2,2,6-trimethylmorpholin-4-yl)pyrrolidin-3-yl]methanamine
SMILESCC1CN(C2(CN)CCN(C3CC3)C2)CC(C)(C)O1
InChIInChI=1S/C15H29N3O/c1-12-8-18(10-14(2,3)19-12)15(9-16)6-7-17(11-15)13-4-5-13/h12-13H,4-11,16H2,1-3H3
InChIKeyNDGIEALFVZCBDF-UHFFFAOYSA-N
MW267.42 g/mol
LogP1.05
Rot. Bonds3

About [1-cyclopropyl-3-(2,2,6-trimethylmorpholin-4-yl)pyrrolidin-3-yl]methanamine

[1-cyclopropyl-3-(2,2,6-trimethylmorpholin-4-yl)pyrrolidin-3-yl]methanamine (PubChem CID 55142181) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is [1-cyclopropyl-3-(2,2,6-trimethylmorpholin-4-yl)pyrrolidin-3-yl]methanamine.

Molecular Properties

Compound Name[1-cyclopropyl-3-(2,2,6-trimethylmorpholin-4-yl)pyrrolidin-3-yl]methanamine
PubChem CID55142181
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC Name[1-cyclopropyl-3-(2,2,6-trimethylmorpholin-4-yl)pyrrolidin-3-yl]methanamine
SMILESCC1CN(C2(CN)CCN(C3CC3)C2)CC(C)(C)O1
InChIInChI=1S/C15H29N3O/c1-12-8-18(10-14(2,3)19-12)15(9-16)6-7-17(11-15)13-4-5-13/h12-13H,4-11,16H2,1-3H3
InChIKeyNDGIEALFVZCBDF-UHFFFAOYSA-N
XLogP1.05
TPSA41.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[3,4-dimethyl-1-(2,2,6-trimethylmorpholin-4-yl)cyclohexyl]methanamine
CID 64745449
[3,3,5,5-tetramethyl-1-(2,2,6-trimethylmorpholin-4-yl)cyclohexyl]methanamine
CID 115999082
[3-propan-2-yl-1-(2,2,6-trimethylmorpholin-4-yl)cyclohexyl]methanamine
CID 107449061
[3-(azepan-1-yl)-1-cyclopropylpyrrolidin-3-yl]methanamine
CID 62976371
[5,5-dimethyl-3-(2,2,6-trimethylmorpholin-4-yl)thian-3-yl]methanamine
CID 79958109
[1-cyclopropyl-3-(4-ethylpiperidin-1-yl)pyrrolidin-3-yl]methanamine
CID 62975832
[4-(2,2,6-trimethylmorpholin-4-yl)-1-azabicyclo[3.2.1]octan-4-yl]methanamine
CID 105365112
[2-methyl-3-(2,2,6-trimethylmorpholin-4-yl)oxolan-3-yl]methanamine
CID 82719280
[2-(2,2,6-trimethylmorpholin-4-yl)-2-bicyclo[4.1.0]heptanyl]methanamine
CID 112740237
[3-(2-cyclopentylpyrrolidin-1-yl)-1-cyclopropylpyrrolidin-3-yl]methanamine
CID 62977325
[1-(4-cyclopropylpiperazin-1-yl)-3,3-dimethylcyclopentyl]methanamine
CID 80705604
[1-(2-methylmorpholin-4-yl)cyclopropyl]methanamine
CID 106660995

Frequently Asked Questions

What is the IUPAC name of [1-cyclopropyl-3-(2,2,6-trimethylmorpholin-4-yl)pyrrolidin-3-yl]methanamine?
The IUPAC name of [1-cyclopropyl-3-(2,2,6-trimethylmorpholin-4-yl)pyrrolidin-3-yl]methanamine (CID 55142181) is [1-cyclopropyl-3-(2,2,6-trimethylmorpholin-4-yl)pyrrolidin-3-yl]methanamine.
What is the SMILES notation for [1-cyclopropyl-3-(2,2,6-trimethylmorpholin-4-yl)pyrrolidin-3-yl]methanamine?
The canonical SMILES for [1-cyclopropyl-3-(2,2,6-trimethylmorpholin-4-yl)pyrrolidin-3-yl]methanamine is CC1CN(C2(CN)CCN(C3CC3)C2)CC(C)(C)O1.
What is the InChIKey of [1-cyclopropyl-3-(2,2,6-trimethylmorpholin-4-yl)pyrrolidin-3-yl]methanamine?
The InChIKey is NDGIEALFVZCBDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-12-8-18(10-14(2,3)19-12)15(9-16)6-7-17(11-15)13-4-5-13/h12-13H,4-11,16H2,1-3H3.
What are the key properties of [1-cyclopropyl-3-(2,2,6-trimethylmorpholin-4-yl)pyrrolidin-3-yl]methanamine?
[1-cyclopropyl-3-(2,2,6-trimethylmorpholin-4-yl)pyrrolidin-3-yl]methanamine has a molecular weight of 267.42 g/mol, XLogP of 1.05, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-cyclopropyl-3-(2,2,6-trimethylmorpholin-4-yl)pyrrolidin-3-yl]methanamine is sourced from PubChem (CID 55142181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).