N-(3-morpholin-4-ylpropyl)-1H-indazol-3-amine

C14H20N4O — CID 3065651

IUPACN-(3-morpholin-4-ylpropyl)-1H-indazol-3-amine
SMILESc1ccc2c(NCCCN3CCOCC3)n[nH]c2c1
InChIInChI=1S/C14H20N4O/c1-2-5-13-12(4-1)14(17-16-13)15-6-3-7-18-8-10-19-11-9-18/h1-2,4-5H,3,6-11H2,(H2,15,16,17)
InChIKeyNIYFKJYEUPPINB-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.70
Rot. Bonds5

About N-(3-morpholin-4-ylpropyl)-1H-indazol-3-amine

N-(3-morpholin-4-ylpropyl)-1H-indazol-3-amine (PubChem CID 3065651) has the molecular formula C14H20N4O and a molecular weight of 260.34 g/mol. Its IUPAC name is N-(3-morpholin-4-ylpropyl)-1H-indazol-3-amine.

Molecular Properties

Compound NameN-(3-morpholin-4-ylpropyl)-1H-indazol-3-amine
PubChem CID3065651
Molecular FormulaC14H20N4O
Molecular Weight260.34 g/mol
Exact Mass260.16
IUPAC NameN-(3-morpholin-4-ylpropyl)-1H-indazol-3-amine
SMILESc1ccc2c(NCCCN3CCOCC3)n[nH]c2c1
InChIInChI=1S/C14H20N4O/c1-2-5-13-12(4-1)14(17-16-13)15-6-3-7-18-8-10-19-11-9-18/h1-2,4-5H,3,6-11H2,(H2,15,16,17)
InChIKeyNIYFKJYEUPPINB-UHFFFAOYSA-N
XLogP1.70
TPSA53.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

6-[2-Amino-6-(Morpholin-4-Yl)pyrimidin-4-Yl]-2h-Indazol-3-Amine
CID 46214653
N-(6-chloro-1H-indazol-3-yl)-4-morpholineacetamide
CID 10085848
N-((1-benzylpiperidin-4-yl)methyl)-1H-indazol-3-amine
CID 46889747
N-(4,5-dihydro-1H-imidazol-2-yl)-1H-indazol-3-amine;hydrochloride
CID 53322685
N-(3-amino-1H-indazol-5-yl)piperidine-4-carboxamide
CID 145950368
4-[3-[2-methoxyethyl(methyl)amino]-1H-indazol-5-yl]-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarbonitrile
CID 91333183
1H-Indazol-3-amine, N-(3-(1-piperidinyl)butyl)-
CID 3021346
1H-Indazol-3-amine, N-(5-methyl-3-(1-piperidinyl)hexyl)-
CID 3021347
1,3-Propanediamine, N,N-diethyl-N'-(1-(3-(1-piperidinyl)propyl)-1H-indazol-3-yl)-
CID 3021348
1H-Indazole-1-propanamine, N,N-diethyl-3-((3-(1-piperidinyl)propyl)amino)-
CID 3021349
1H-Indazole-1-propanamine, N,N-diethyl-3-((6-(1-piperidinyl)hexyl)amino)-
CID 3021350
1H-Indazole-1-propanamine, N,N-diethyl-3-((3-(1-piperidinyl)butyl)amino)-
CID 3021352

Frequently Asked Questions

What is the IUPAC name of N-(3-morpholin-4-ylpropyl)-1H-indazol-3-amine?
The IUPAC name of N-(3-morpholin-4-ylpropyl)-1H-indazol-3-amine (CID 3065651) is N-(3-morpholin-4-ylpropyl)-1H-indazol-3-amine.
What is the SMILES notation for N-(3-morpholin-4-ylpropyl)-1H-indazol-3-amine?
The canonical SMILES for N-(3-morpholin-4-ylpropyl)-1H-indazol-3-amine is c1ccc2c(NCCCN3CCOCC3)n[nH]c2c1.
What is the InChIKey of N-(3-morpholin-4-ylpropyl)-1H-indazol-3-amine?
The InChIKey is NIYFKJYEUPPINB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O/c1-2-5-13-12(4-1)14(17-16-13)15-6-3-7-18-8-10-19-11-9-18/h1-2,4-5H,3,6-11H2,(H2,15,16,17).
What are the key properties of N-(3-morpholin-4-ylpropyl)-1H-indazol-3-amine?
N-(3-morpholin-4-ylpropyl)-1H-indazol-3-amine has a molecular weight of 260.34 g/mol, XLogP of 1.70, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-morpholin-4-ylpropyl)-1H-indazol-3-amine is sourced from PubChem (CID 3065651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).