N-[(2-methylpyrazol-3-yl)-(4-propan-2-ylmorpholin-2-yl)methyl]propan-1-amine

C15H28N4O — CID 79662895

IUPACN-[(2-methylpyrazol-3-yl)-(4-propan-2-ylmorpholin-2-yl)methyl]propan-1-amine
SMILESCCCNC(c1ccnn1C)C1CN(C(C)C)CCO1
InChIInChI=1S/C15H28N4O/c1-5-7-16-15(13-6-8-17-18(13)4)14-11-19(12(2)3)9-10-20-14/h6,8,12,14-16H,5,7,9-11H2,1-4H3
InChIKeyKCSOCZFZXBMIIU-UHFFFAOYSA-N
MW280.42 g/mol
LogP1.57
Rot. Bonds6

About N-[(2-methylpyrazol-3-yl)-(4-propan-2-ylmorpholin-2-yl)methyl]propan-1-amine

N-[(2-methylpyrazol-3-yl)-(4-propan-2-ylmorpholin-2-yl)methyl]propan-1-amine (PubChem CID 79662895) has the molecular formula C15H28N4O and a molecular weight of 280.42 g/mol. Its IUPAC name is N-[(2-methylpyrazol-3-yl)-(4-propan-2-ylmorpholin-2-yl)methyl]propan-1-amine.

Molecular Properties

Compound NameN-[(2-methylpyrazol-3-yl)-(4-propan-2-ylmorpholin-2-yl)methyl]propan-1-amine
PubChem CID79662895
Molecular FormulaC15H28N4O
Molecular Weight280.42 g/mol
Exact Mass280.23
IUPAC NameN-[(2-methylpyrazol-3-yl)-(4-propan-2-ylmorpholin-2-yl)methyl]propan-1-amine
SMILESCCCNC(c1ccnn1C)C1CN(C(C)C)CCO1
InChIInChI=1S/C15H28N4O/c1-5-7-16-15(13-6-8-17-18(13)4)14-11-19(12(2)3)9-10-20-14/h6,8,12,14-16H,5,7,9-11H2,1-4H3
InChIKeyKCSOCZFZXBMIIU-UHFFFAOYSA-N
XLogP1.57
TPSA42.32 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.42
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(4-propan-2-ylmorpholin-2-yl)-(propylamino)methyl]pyridin-4-amine
CID 79662633
N-[(4-propan-2-ylmorpholin-2-yl)-pyrimidin-5-ylmethyl]propan-1-amine
CID 79665233
N-[(1-ethylimidazol-2-yl)-(4-propan-2-ylmorpholin-2-yl)methyl]propan-1-amine
CID 79665969
(4-propan-2-ylmorpholin-2-yl)-(2-propylpyrazol-3-yl)methanamine
CID 79664704
N-[(5-methylthiophen-3-yl)-(4-propan-2-ylmorpholin-2-yl)methyl]propan-1-amine
CID 79663833
N-[2-(1-methylpyrazol-4-yl)-1-(4-propan-2-ylmorpholin-2-yl)ethyl]propan-1-amine
CID 79665970
[(4-methylmorpholin-2-yl)-(2-methylpyrazol-3-yl)methyl]hydrazine
CID 105244278
N-[2,3-dihydro-1,4-benzodioxin-3-yl-(2-methylpyrazol-3-yl)methyl]propan-1-amine
CID 65351567
N-[cyclopropyl-(4-propan-2-ylmorpholin-2-yl)methyl]propan-1-amine
CID 79664305
N-[(4-ethylcyclohexyl)-(2-methylpyrazol-3-yl)methyl]propan-1-amine
CID 65395621
N-[1-(4-propan-2-ylmorpholin-2-yl)-2-thiophen-2-ylethyl]propan-1-amine
CID 79664970
N-[1,4-oxathian-2-yl-(2-propylpyrazol-3-yl)methyl]propan-1-amine
CID 79963660

Frequently Asked Questions

What is the IUPAC name of N-[(2-methylpyrazol-3-yl)-(4-propan-2-ylmorpholin-2-yl)methyl]propan-1-amine?
The IUPAC name of N-[(2-methylpyrazol-3-yl)-(4-propan-2-ylmorpholin-2-yl)methyl]propan-1-amine (CID 79662895) is N-[(2-methylpyrazol-3-yl)-(4-propan-2-ylmorpholin-2-yl)methyl]propan-1-amine.
What is the SMILES notation for N-[(2-methylpyrazol-3-yl)-(4-propan-2-ylmorpholin-2-yl)methyl]propan-1-amine?
The canonical SMILES for N-[(2-methylpyrazol-3-yl)-(4-propan-2-ylmorpholin-2-yl)methyl]propan-1-amine is CCCNC(c1ccnn1C)C1CN(C(C)C)CCO1.
What is the InChIKey of N-[(2-methylpyrazol-3-yl)-(4-propan-2-ylmorpholin-2-yl)methyl]propan-1-amine?
The InChIKey is KCSOCZFZXBMIIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4O/c1-5-7-16-15(13-6-8-17-18(13)4)14-11-19(12(2)3)9-10-20-14/h6,8,12,14-16H,5,7,9-11H2,1-4H3.
What are the key properties of N-[(2-methylpyrazol-3-yl)-(4-propan-2-ylmorpholin-2-yl)methyl]propan-1-amine?
N-[(2-methylpyrazol-3-yl)-(4-propan-2-ylmorpholin-2-yl)methyl]propan-1-amine has a molecular weight of 280.42 g/mol, XLogP of 1.57, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylpyrazol-3-yl)-(4-propan-2-ylmorpholin-2-yl)methyl]propan-1-amine is sourced from PubChem (CID 79662895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).