N-[[4-(2-piperidin-1-ylethyl)morpholin-2-yl]methyl]pyridazin-3-amine

C16H27N5O — CID 71872248

IUPACN-[[4-(2-piperidin-1-ylethyl)morpholin-2-yl]methyl]pyridazin-3-amine
SMILESc1cnnc(NCC2CN(CCN3CCCCC3)CCO2)c1
InChIInChI=1S/C16H27N5O/c1-2-7-20(8-3-1)9-10-21-11-12-22-15(14-21)13-17-16-5-4-6-18-19-16/h4-6,15H,1-3,7-14H2,(H,17,19)
InChIKeyNWHVTTIBRPZNNK-UHFFFAOYSA-N
MW305.43 g/mol
LogP1.08
Rot. Bonds6

About N-[[4-(2-piperidin-1-ylethyl)morpholin-2-yl]methyl]pyridazin-3-amine

N-[[4-(2-piperidin-1-ylethyl)morpholin-2-yl]methyl]pyridazin-3-amine (PubChem CID 71872248) has the molecular formula C16H27N5O and a molecular weight of 305.43 g/mol. Its IUPAC name is N-[[4-(2-piperidin-1-ylethyl)morpholin-2-yl]methyl]pyridazin-3-amine.

Molecular Properties

Compound NameN-[[4-(2-piperidin-1-ylethyl)morpholin-2-yl]methyl]pyridazin-3-amine
PubChem CID71872248
Molecular FormulaC16H27N5O
Molecular Weight305.43 g/mol
Exact Mass305.22
IUPAC NameN-[[4-(2-piperidin-1-ylethyl)morpholin-2-yl]methyl]pyridazin-3-amine
SMILESc1cnnc(NCC2CN(CCN3CCCCC3)CCO2)c1
InChIInChI=1S/C16H27N5O/c1-2-7-20(8-3-1)9-10-21-11-12-22-15(14-21)13-17-16-5-4-6-18-19-16/h4-6,15H,1-3,7-14H2,(H,17,19)
InChIKeyNWHVTTIBRPZNNK-UHFFFAOYSA-N
XLogP1.08
TPSA53.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.43
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[[4-(2-piperidin-1-ylethyl)morpholin-2-yl]methyl]pyridazin-3-amine?
The IUPAC name of N-[[4-(2-piperidin-1-ylethyl)morpholin-2-yl]methyl]pyridazin-3-amine (CID 71872248) is N-[[4-(2-piperidin-1-ylethyl)morpholin-2-yl]methyl]pyridazin-3-amine.
What is the SMILES notation for N-[[4-(2-piperidin-1-ylethyl)morpholin-2-yl]methyl]pyridazin-3-amine?
The canonical SMILES for N-[[4-(2-piperidin-1-ylethyl)morpholin-2-yl]methyl]pyridazin-3-amine is c1cnnc(NCC2CN(CCN3CCCCC3)CCO2)c1.
What is the InChIKey of N-[[4-(2-piperidin-1-ylethyl)morpholin-2-yl]methyl]pyridazin-3-amine?
The InChIKey is NWHVTTIBRPZNNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N5O/c1-2-7-20(8-3-1)9-10-21-11-12-22-15(14-21)13-17-16-5-4-6-18-19-16/h4-6,15H,1-3,7-14H2,(H,17,19).
What are the key properties of N-[[4-(2-piperidin-1-ylethyl)morpholin-2-yl]methyl]pyridazin-3-amine?
N-[[4-(2-piperidin-1-ylethyl)morpholin-2-yl]methyl]pyridazin-3-amine has a molecular weight of 305.43 g/mol, XLogP of 1.08, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(2-piperidin-1-ylethyl)morpholin-2-yl]methyl]pyridazin-3-amine is sourced from PubChem (CID 71872248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).