(3-methyltriazol-4-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine

C11H21N5O — CID 114688564

IUPAC(3-methyltriazol-4-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine
SMILESCC(C)N1CCOC(C(N)c2cnnn2C)C1
InChIInChI=1S/C11H21N5O/c1-8(2)16-4-5-17-10(7-16)11(12)9-6-13-14-15(9)3/h6,8,10-11H,4-5,7,12H2,1-3H3
InChIKeyJKLZLNZBLKJHLR-UHFFFAOYSA-N
MW239.32 g/mol
LogP-0.08
Rot. Bonds3

About (3-methyltriazol-4-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine

(3-methyltriazol-4-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine (PubChem CID 114688564) has the molecular formula C11H21N5O and a molecular weight of 239.32 g/mol. Its IUPAC name is (3-methyltriazol-4-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine.

Molecular Properties

Compound Name(3-methyltriazol-4-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine
PubChem CID114688564
Molecular FormulaC11H21N5O
Molecular Weight239.32 g/mol
Exact Mass239.17
IUPAC Name(3-methyltriazol-4-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine
SMILESCC(C)N1CCOC(C(N)c2cnnn2C)C1
InChIInChI=1S/C11H21N5O/c1-8(2)16-4-5-17-10(7-16)11(12)9-6-13-14-15(9)3/h6,8,10-11H,4-5,7,12H2,1-3H3
InChIKeyJKLZLNZBLKJHLR-UHFFFAOYSA-N
XLogP-0.08
TPSA69.20 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 5-0.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

phenyl-(4-propan-2-ylmorpholin-2-yl)methanamine
CID 79665183
(4-propan-2-ylmorpholin-2-yl)-(2-propylpyrazol-3-yl)methanamine
CID 79664704
(3-methoxypyrazin-2-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine
CID 104515903
(4-propylmorpholin-2-yl)-(3-propyltriazol-4-yl)methanamine
CID 114688558
(4-methoxy-1-propan-2-ylpyrazol-5-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine
CID 114657848
(2,3-dichlorophenyl)-(4-propan-2-ylmorpholin-2-yl)methanamine
CID 79665565
(4-propan-2-ylmorpholin-2-yl)-quinolin-3-ylmethanamine
CID 79665562
(2-ethoxyphenyl)-(4-propan-2-ylmorpholin-2-yl)methanamine
CID 79664711
(2-phenylcyclopropyl)-(4-propan-2-ylmorpholin-2-yl)methanamine
CID 116517749
(4-ethylmorpholin-2-yl)-(3-phenyltriazol-4-yl)methanamine
CID 114688550
1-(4-propan-2-ylmorpholin-2-yl)ethanol
CID 79663544
[(4-methoxy-1-methylpyrazol-5-yl)-(4-propan-2-ylmorpholin-2-yl)methyl]hydrazine
CID 105248155

Frequently Asked Questions

What is the IUPAC name of (3-methyltriazol-4-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine?
The IUPAC name of (3-methyltriazol-4-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine (CID 114688564) is (3-methyltriazol-4-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine.
What is the SMILES notation for (3-methyltriazol-4-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine?
The canonical SMILES for (3-methyltriazol-4-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine is CC(C)N1CCOC(C(N)c2cnnn2C)C1.
What is the InChIKey of (3-methyltriazol-4-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine?
The InChIKey is JKLZLNZBLKJHLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N5O/c1-8(2)16-4-5-17-10(7-16)11(12)9-6-13-14-15(9)3/h6,8,10-11H,4-5,7,12H2,1-3H3.
What are the key properties of (3-methyltriazol-4-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine?
(3-methyltriazol-4-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine has a molecular weight of 239.32 g/mol, XLogP of -0.08, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methyltriazol-4-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine is sourced from PubChem (CID 114688564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).