6-cyclopropyl-4-(2-morpholin-4-ylpyridine-4-carboximidoyl)pyridin-3-amine

C18H21N5O — CID 139566216

IUPAC6-cyclopropyl-4-(2-morpholin-4-ylpyridine-4-carboximidoyl)pyridin-3-amine
SMILES[H]/N=C(\c1ccnc(N2CCOCC2)c1)c1cc(C2CC2)ncc1N
InChIInChI=1S/C18H21N5O/c19-15-11-22-16(12-1-2-12)10-14(15)18(20)13-3-4-21-17(9-13)23-5-7-24-8-6-23/h3-4,9-12,20H,1-2,5-8,19H2/b20-18+
InChIKeyJYAYGETVNQVLQR-CZIZESTLSA-N
MW323.40 g/mol
LogP2.19
Rot. Bonds4

About 6-cyclopropyl-4-(2-morpholin-4-ylpyridine-4-carboximidoyl)pyridin-3-amine

6-cyclopropyl-4-(2-morpholin-4-ylpyridine-4-carboximidoyl)pyridin-3-amine (PubChem CID 139566216) has the molecular formula C18H21N5O and a molecular weight of 323.40 g/mol. Its IUPAC name is 6-cyclopropyl-4-(2-morpholin-4-ylpyridine-4-carboximidoyl)pyridin-3-amine.

Molecular Properties

Compound Name6-cyclopropyl-4-(2-morpholin-4-ylpyridine-4-carboximidoyl)pyridin-3-amine
PubChem CID139566216
Molecular FormulaC18H21N5O
Molecular Weight323.40 g/mol
Exact Mass323.17
IUPAC Name6-cyclopropyl-4-(2-morpholin-4-ylpyridine-4-carboximidoyl)pyridin-3-amine
SMILES[H]/N=C(\c1ccnc(N2CCOCC2)c1)c1cc(C2CC2)ncc1N
InChIInChI=1S/C18H21N5O/c19-15-11-22-16(12-1-2-12)10-14(15)18(20)13-3-4-21-17(9-13)23-5-7-24-8-6-23/h3-4,9-12,20H,1-2,5-8,19H2/b20-18+
InChIKeyJYAYGETVNQVLQR-CZIZESTLSA-N
XLogP2.19
TPSA88.12 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

6-(1-methylcyclopropyl)oxy-4-(2-morpholin-4-ylpyridine-4-carboximidoyl)pyridin-3-amine
CID 139566231
2-(2-morpholin-4-ylpyridine-4-carboximidoyl)-4-(1,3-oxazol-2-yl)aniline
CID 144697869
2-(2-morpholin-4-ylpyridine-4-carboximidoyl)-4-(1H-pyrazol-4-yl)aniline
CID 123496232
ethane;6-(1-methylcyclopropyl)oxy-4-(2-morpholin-4-ylpyridine-4-carboximidoyl)pyridin-3-amine
CID 144795228
4-(5-methoxypyrimidin-2-yl)-2-(2-morpholin-4-ylpyridine-4-carboximidoyl)aniline
CID 123710007
molecular hydrogen;2-(2-morpholin-4-ylpyridine-4-carboximidoyl)-4-(oxetan-3-yloxy)aniline
CID 144695104
3-(2-morpholin-4-ylpyridine-4-carboximidoyl)-5-propan-2-yloxypyridin-2-amine
CID 139566238
6-methoxy-2-(2-morpholin-4-ylpyridine-4-carboximidoyl)pyridin-3-amine
CID 144795332
4-(4-methoxy-6-methylpyrimidin-5-yl)-2-(2-morpholin-4-ylpyridine-4-carboximidoyl)aniline;molecular hydrogen
CID 144697815
4-cyclopropyloxy-2-(2-pyrrolidin-1-ylpyridine-4-carboximidoyl)aniline
CID 123493964
4-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pyridine-4-carboximidoyl]-6-propan-2-yloxypyridin-3-amine
CID 144795347
2-(1,4-oxazepan-4-yl)pyridine-4-carboximidamide
CID 62973407

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-4-(2-morpholin-4-ylpyridine-4-carboximidoyl)pyridin-3-amine?
The IUPAC name of 6-cyclopropyl-4-(2-morpholin-4-ylpyridine-4-carboximidoyl)pyridin-3-amine (CID 139566216) is 6-cyclopropyl-4-(2-morpholin-4-ylpyridine-4-carboximidoyl)pyridin-3-amine.
What is the SMILES notation for 6-cyclopropyl-4-(2-morpholin-4-ylpyridine-4-carboximidoyl)pyridin-3-amine?
The canonical SMILES for 6-cyclopropyl-4-(2-morpholin-4-ylpyridine-4-carboximidoyl)pyridin-3-amine is [H]/N=C(\c1ccnc(N2CCOCC2)c1)c1cc(C2CC2)ncc1N.
What is the InChIKey of 6-cyclopropyl-4-(2-morpholin-4-ylpyridine-4-carboximidoyl)pyridin-3-amine?
The InChIKey is JYAYGETVNQVLQR-CZIZESTLSA-N. The full InChI is InChI=1S/C18H21N5O/c19-15-11-22-16(12-1-2-12)10-14(15)18(20)13-3-4-21-17(9-13)23-5-7-24-8-6-23/h3-4,9-12,20H,1-2,5-8,19H2/b20-18+.
What are the key properties of 6-cyclopropyl-4-(2-morpholin-4-ylpyridine-4-carboximidoyl)pyridin-3-amine?
6-cyclopropyl-4-(2-morpholin-4-ylpyridine-4-carboximidoyl)pyridin-3-amine has a molecular weight of 323.40 g/mol, XLogP of 2.19, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-4-(2-morpholin-4-ylpyridine-4-carboximidoyl)pyridin-3-amine is sourced from PubChem (CID 139566216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).