tert-butyl 4-(4-amino-6-morpholin-4-yl-3-pyridinyl)piperidine-1-carboxylate

C19H30N4O3 — CID 66632323

IUPACtert-butyl 4-(4-amino-6-morpholin-4-yl-3-pyridinyl)piperidine-1-carboxylate
SMILESCC(C)(C)OC(=O)N1CCC(c2cnc(N3CCOCC3)cc2N)CC1
InChIInChI=1S/C19H30N4O3/c1-19(2,3)26-18(24)23-6-4-14(5-7-23)15-13-21-17(12-16(15)20)22-8-10-25-11-9-22/h12-14H,4-11H2,1-3H3,(H2,20,21)
InChIKeyGORJOWGGHAFPJA-UHFFFAOYSA-N
MW362.47 g/mol
LogP2.61
Rot. Bonds2

About tert-butyl 4-(4-amino-6-morpholin-4-yl-3-pyridinyl)piperidine-1-carboxylate

tert-butyl 4-(4-amino-6-morpholin-4-yl-3-pyridinyl)piperidine-1-carboxylate (PubChem CID 66632323) has the molecular formula C19H30N4O3 and a molecular weight of 362.47 g/mol. Its IUPAC name is tert-butyl 4-(4-amino-6-morpholin-4-yl-3-pyridinyl)piperidine-1-carboxylate.

Molecular Properties

Compound Nametert-butyl 4-(4-amino-6-morpholin-4-yl-3-pyridinyl)piperidine-1-carboxylate
PubChem CID66632323
Molecular FormulaC19H30N4O3
Molecular Weight362.47 g/mol
Exact Mass362.23
IUPAC Nametert-butyl 4-(4-amino-6-morpholin-4-yl-3-pyridinyl)piperidine-1-carboxylate
SMILESCC(C)(C)OC(=O)N1CCC(c2cnc(N3CCOCC3)cc2N)CC1
InChIInChI=1S/C19H30N4O3/c1-19(2,3)26-18(24)23-6-4-14(5-7-23)15-13-21-17(12-16(15)20)22-8-10-25-11-9-22/h12-14H,4-11H2,1-3H3,(H2,20,21)
InChIKeyGORJOWGGHAFPJA-UHFFFAOYSA-N
XLogP2.61
TPSA80.92 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.47
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of tert-butyl 4-(4-amino-6-morpholin-4-yl-3-pyridinyl)piperidine-1-carboxylate?
The IUPAC name of tert-butyl 4-(4-amino-6-morpholin-4-yl-3-pyridinyl)piperidine-1-carboxylate (CID 66632323) is tert-butyl 4-(4-amino-6-morpholin-4-yl-3-pyridinyl)piperidine-1-carboxylate.
What is the SMILES notation for tert-butyl 4-(4-amino-6-morpholin-4-yl-3-pyridinyl)piperidine-1-carboxylate?
The canonical SMILES for tert-butyl 4-(4-amino-6-morpholin-4-yl-3-pyridinyl)piperidine-1-carboxylate is CC(C)(C)OC(=O)N1CCC(c2cnc(N3CCOCC3)cc2N)CC1.
What is the InChIKey of tert-butyl 4-(4-amino-6-morpholin-4-yl-3-pyridinyl)piperidine-1-carboxylate?
The InChIKey is GORJOWGGHAFPJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N4O3/c1-19(2,3)26-18(24)23-6-4-14(5-7-23)15-13-21-17(12-16(15)20)22-8-10-25-11-9-22/h12-14H,4-11H2,1-3H3,(H2,20,21).
What are the key properties of tert-butyl 4-(4-amino-6-morpholin-4-yl-3-pyridinyl)piperidine-1-carboxylate?
tert-butyl 4-(4-amino-6-morpholin-4-yl-3-pyridinyl)piperidine-1-carboxylate has a molecular weight of 362.47 g/mol, XLogP of 2.61, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl 4-(4-amino-6-morpholin-4-yl-3-pyridinyl)piperidine-1-carboxylate is sourced from PubChem (CID 66632323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).