(4-propylmorpholin-2-yl)-pyrimidin-5-ylmethanamine

C12H20N4O — CID 79657464

IUPAC(4-propylmorpholin-2-yl)-pyrimidin-5-ylmethanamine
SMILESCCCN1CCOC(C(N)c2cncnc2)C1
InChIInChI=1S/C12H20N4O/c1-2-3-16-4-5-17-11(8-16)12(13)10-6-14-9-15-7-10/h6-7,9,11-12H,2-5,8,13H2,1H3
InChIKeyNNEGQRCCGSBDJD-UHFFFAOYSA-N
MW236.32 g/mol
LogP0.59
Rot. Bonds4

About (4-propylmorpholin-2-yl)-pyrimidin-5-ylmethanamine

(4-propylmorpholin-2-yl)-pyrimidin-5-ylmethanamine (PubChem CID 79657464) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is (4-propylmorpholin-2-yl)-pyrimidin-5-ylmethanamine.

Molecular Properties

Compound Name(4-propylmorpholin-2-yl)-pyrimidin-5-ylmethanamine
PubChem CID79657464
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name(4-propylmorpholin-2-yl)-pyrimidin-5-ylmethanamine
SMILESCCCN1CCOC(C(N)c2cncnc2)C1
InChIInChI=1S/C12H20N4O/c1-2-3-16-4-5-17-11(8-16)12(13)10-6-14-9-15-7-10/h6-7,9,11-12H,2-5,8,13H2,1H3
InChIKeyNNEGQRCCGSBDJD-UHFFFAOYSA-N
XLogP0.59
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

phenyl-(4-propylmorpholin-2-yl)methanamine
CID 79657763
furan-3-yl-(4-propylmorpholin-2-yl)methanamine
CID 79658317
3-[amino-(4-propylmorpholin-2-yl)methyl]pyridin-4-amine
CID 79657694
(4-propylmorpholin-2-yl)-(3-propyltriazol-4-yl)methanamine
CID 114688558
isoquinolin-4-yl-(4-propylmorpholin-2-yl)methanamine
CID 79663744
1-(4-propylmorpholin-2-yl)ethanamine
CID 79658084
1-(4-propylmorpholin-2-yl)-2-pyridin-4-ylethanamine
CID 79657163
3,4-dihydro-2H-pyran-6-yl-(4-propylmorpholin-2-yl)methanamine
CID 102647810
(1-ethyl-4-methoxypyrazol-5-yl)-(4-propylmorpholin-2-yl)methanamine
CID 114657813
3-[amino-(4-propylmorpholin-2-yl)methyl]-4-methylpyridin-2-amine
CID 79658236
2-propan-2-yl-4-propylmorpholine
CID 58468712
(2,6-difluoro-3-methylphenyl)-(4-propylmorpholin-2-yl)methanamine
CID 82822230

Frequently Asked Questions

What is the IUPAC name of (4-propylmorpholin-2-yl)-pyrimidin-5-ylmethanamine?
The IUPAC name of (4-propylmorpholin-2-yl)-pyrimidin-5-ylmethanamine (CID 79657464) is (4-propylmorpholin-2-yl)-pyrimidin-5-ylmethanamine.
What is the SMILES notation for (4-propylmorpholin-2-yl)-pyrimidin-5-ylmethanamine?
The canonical SMILES for (4-propylmorpholin-2-yl)-pyrimidin-5-ylmethanamine is CCCN1CCOC(C(N)c2cncnc2)C1.
What is the InChIKey of (4-propylmorpholin-2-yl)-pyrimidin-5-ylmethanamine?
The InChIKey is NNEGQRCCGSBDJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-2-3-16-4-5-17-11(8-16)12(13)10-6-14-9-15-7-10/h6-7,9,11-12H,2-5,8,13H2,1H3.
What are the key properties of (4-propylmorpholin-2-yl)-pyrimidin-5-ylmethanamine?
(4-propylmorpholin-2-yl)-pyrimidin-5-ylmethanamine has a molecular weight of 236.32 g/mol, XLogP of 0.59, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4-propylmorpholin-2-yl)-pyrimidin-5-ylmethanamine is sourced from PubChem (CID 79657464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).